SCHEMBL1971111

SCHEMBL1971111

NCCc1c[nH]c2cc(Cl)ccc12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 10/20 0.76
TRPM8 Q7Z2W7 3/20 0.76
GPR84 Q9NQS5 2/20 0.69
HTR2C P28335 4/20 0.66
SLC6A4 P31645 1/20 0.61
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
HTR1D P28221 3/20 0.59
MPO P05164 2/20 0.59
CYP1A2 P05177 2/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2D6 P10635 2/20 0.59
HTR1B P28222 2/20 0.59
HTR7 P34969 2/20 0.59
HTR6 P50406 2/20 0.59
TAAR1 Q96RJ0 2/20 0.59
CYP2A6 P11509 1/20 0.59
NFKB1 P19838 1/20 0.59
CTSK P43235 1/20 0.59
CYP2A13 Q16696 1/20 0.59

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL30396693 0.98 HTR2A (0.73) HTR2ATRPM8GPR84HTR2CSLC6A4
Hydrochloric Acid SCHEMBL2537521 0.98 HTR2A (0.73) HTR2ATRPM8GPR84HTR2CSLC6A4
SCHEMBL30724496 0.86 HTR2A (1.00) HTR2ATRPM8GPR84HTR2CSLC6A4
SCHEMBL626030 0.86 HTR2A (1.00) HTR2ATRPM8GPR84HTR2CSLC6A4
SCHEMBL3280241 0.86 GPR84 (0.73) HTR2ATRPM8GPR84HTR2CSLC6A4
Methane SCHEMBL26617454 0.85 HTR2A (0.97) HTR2ATRPM8GPR84HTR2CSLC6A4
Hydrochloric Acid SCHEMBL892839 0.85 HTR2A (0.97) HTR2ATRPM8GPR84HTR2CSLC6A4
Hydrochloric Acid SCHEMBL686594 0.85 HTR2A (0.97) HTR2ATRPM8GPR84HTR2CSLC6A4
SCHEMBL24452687 0.83 GPR84 (0.69) HTR2ATRPM8GPR84HTR2CSLC6A4
SCHEMBL3181757 0.83 GPR84 (0.69) HTR2ATRPM8GPR84HTR2CSLC6A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1519932-B1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LTD (GB) 2007-10-03 EP claimed
US-20050215548-A1 Capable of binding to the oncoprotein HDM2 and modulating the HDM2-dependent regulation of the tumour suppressor p53 and/or E2F transcription factors; e.g. 5-Chloro-4-nitro-thiophene-2-sulfonic acid (4-nitrophenyl)-amide CYCLACEL LIMITED (GB) 2005-09-29 US claimed
EP-1519932-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY Cyclacel Limited (GB) 2005-04-06 EP claimed
WO-2004005278-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LIMITED (GB) 2004-01-15 WO claimed
US-12630512-B2 Agents for differentiating stem cells and treating cancer MINERVA BIOTECHNOLOGIES CORPORATION (US) 2026-05-19 US disclosed
US-20260071243-A1 BIOLOGICAL PRODUCTION OF TRYPTOPHAN-DERIVED PRODUCTS UNIV TEXAS (US) 2026-03-12 US disclosed
EP-3600451-B1 AGENTS FOR DIFFERENTIATING STEM CELLS AND TREATING CANCER MINERVA BIOTECHNOLOGIES CORP (US) 2025-12-24 EP disclosed
US-20250354108-A1 METHODS FOR PRODUCING MONOTERPENE INDOLE ALKALOIDS UNIV DANMARKS TEKNISKE (DK) 2025-11-20 US disclosed
US-20250057861-A1 HALOGENATED PSILOCYBIN DERIVATIVES AND METHODS OF USING Enveric Biosciences Canada Inc. (CA) 2025-02-20 US disclosed
US-12202799-B2 Agents for differentiating stem cells and treating cancer MINERVA BIOTECHNOLOGIES CORPORATION (US) 2025-01-21 US disclosed
US-20240409515-A1 AGENTS FOR DIFFERENTIATING STEM CELLS AND TREATING CANCER MINERVA BIOTECHNOLOGIES CORPORATION 2024-12-12 US disclosed
US-12138276-B2 Halogenated psilocybin derivatives and methods of using Enveric Biosciences Canada Inc. (CA) 2024-11-12 US disclosed
WO-2004005278-A1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LIMITED (GB) 2004-01-15 WO disclosed
EP-1379239-A2 N-(2-ARYLETHYL) BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2004-01-14 EP disclosed
WO-2002078693-A2 N-(2-ARYLETHYL)BENZYLAMINES AS ANTAGONISTS OF THE 5-HT6 RECEPTOR ELI LILLY AND COMPANY (US) 2002-10-10 WO disclosed
US-5332748-A Antiischemic, antianoxic ROUSSEL-UCLAF (FR) 1994-07-26 US disclosed
EP-0317427-B1 Substituted derivatives of 20,21-dinoreburnamenine, process for their preparation and intermediates obtained in this way, their use as medicines, and pharmaceutical compositions containing them ROUSSEL UCLAF (FR) 1994-01-12 EP disclosed
US-5093337-A SUBSTITUTED DERIVATIVES OF 20,21-DINOREBURNAMENINE, THEIR USE AS MEDICAMENTS AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ROUSSEL UCLAF (FR) 1992-03-03 US disclosed
EP-0317427-A1 Substituted derivatives of 20,21-dinoreburnamenine, process for their preparation and intermediates obtained in this way, their use as medicines, and pharmaceutical compositions containing them ROUSSEL-UCLAF (FR) 1989-05-24 EP disclosed
US-4138489-A FORMALDEHYDE, QUATERNIZATION AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1979-02-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12138276-B2 Halogenated psilocybin derivatives and methods of using CES2, MAOB, CNR1 HTR2A 150/4885TRPM8 3552/4885GPR84 2304/4885
US-12202799-B2 Agents for differentiating stem cells and treating cancer MCL1, CD44, CRABP2 HTR2A 4440/4885TRPM8 3417/4885GPR84 2212/4885
US-12630512-B2 Agents for differentiating stem cells and treating cancer MCL1, POU2F1, NES HTR2A 3307/4885TRPM8 2318/4885GPR84 2628/4885
US-20240409515-A1 AGENTS FOR DIFFERENTIATING STEM CELLS AND TREATING CANCER MCL1, CD44, CRABP2 HTR2A 4440/4885TRPM8 3417/4885GPR84 2212/4885
US-20050215548-A1 Capable of binding to the oncoprotein HDM2 and modulating the HDM2-dependent regulation of the tumour suppressor p53 and/or E2F transcription factors; e.g. 5-Chloro-4-nitro-thiophene-2-sulfonic acid (4-nitrophenyl)-amide CCNL2, TP53, MDM2 HTR2A 2487/4885TRPM8 3901/4885GPR84 3943/4885
US-20260071243-A1 BIOLOGICAL PRODUCTION OF TRYPTOPHAN-DERIVED PRODUCTS TPH1, TPH2, SLC6A4 HTR2A 8/4885TRPM8 3842/4885GPR84 1628/4885
US-20250057861-A1 HALOGENATED PSILOCYBIN DERIVATIVES AND METHODS OF USING CES2, MAOB, CNR1 HTR2A 150/4885TRPM8 3552/4885GPR84 2304/4885
US-20250354108-A1 METHODS FOR PRODUCING MONOTERPENE INDOLE ALKALOIDS INMT, KARS1, MIA3 HTR2A 2339/4885TRPM8 3824/4885GPR84 3005/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.