SCHEMBL107103

SCHEMBL107103

Fc1ccc2c(c1)CNC2

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CHRNB2 P17787 2/20 0.41
CHRNB4 P30926 2/20 0.41
CHRNA3 P32297 2/20 0.41
CHRNA4 P43681 2/20 0.41
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
PARP1 P09874 1/20 0.38
PARP10 Q53GL7 1/20 0.38
MELK Q14680 1/20 0.38
CHRNA7 P36544 1/20 0.38
PNMT P11086 3/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
ASIC3 Q9UHC3 1/20 0.38
HTR5A P47898 1/20 0.37

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 SCHEMBL1266812 0.98 CYP1A2 (0.42) CYP1A2CYP2D6CHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL2315581 0.95 CYP1A2 (0.41) CYP1A2CYP2D6CHRNB2CHRNB4CHRNA3
SCHEMBL22638762 0.82 CYP2D6 (0.49) CYP1A2CYP2D6MELKASIC3
SCHEMBL330372 0.82 ASIC3 (0.60) HTR2AHTR2CMELKPNMTADRA2A
SCHEMBL420370 0.82 PNMT (0.60) HTR2AHTR2CMELKPNMTADRA2A
SCHEMBL29386484 0.82 CYP2D6 (0.49) CYP1A2CYP2D6MELKASIC3
SCHEMBL29741628 0.82 PNMT (0.60) HTR2AHTR2CMELKPNMTADRA2A
SCHEMBL31468751 0.81 PARP1 (0.36) CYP1A2CYP2D6CHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL1000880 0.81 ASIC3 (0.58) HTR2AHTR2CMELKPNMTADRA2A
Hydrochloric Acid SCHEMBL29586555 0.81 PNMT (0.58) HTR2AHTR2CMELKPNMTADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12624024-B2 EP2 antagonist compounds RESERVOIR NEUROSCIENCE, INC. (US) 2026-05-12 US disclosed
EP-4680612-A1 CHEMICAL COMPOUNDS AN2 Therapeutics, Inc. (US) 2026-01-21 EP disclosed
US-20250263394-A1 COMPOUNDS, PREPARATION METHODS AND USES THEREOF INVENTISBIO LLC 2025-08-21 US disclosed
US-20250206752-A1 PI3K INHIBITORS COGENT BIOSCIENCES, INC. 2025-06-26 US disclosed
US-20250144094-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. 2025-05-08 US disclosed
CN-119948023-A Regulator containing piperidine polycyclic derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2025-05-06 CN disclosed
US-12281122-B1 PI3K inhibitors COGENT BIOSCIENCES, INC. (US) 2025-04-22 US disclosed
WO-2025051216-A1 CYP11A1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 深圳众格生物科技有限公司 2025-03-13 WO disclosed
WO-2025040167-A1 PHOSPHOINOSITIDE 3-KINASE ALLOSTERIC INHIBITOR FOR TREATING DISEASE RELATED TO PI3K REGULATION 上海艾力斯医药科技股份有限公司 2025-02-27 WO disclosed
WO-2025029683-A1 PI3K INHIBITORS COGENT BIOSCIENCES, INC. (US) 2025-02-06 WO disclosed
EP-1595866-A1 COMPOUND INHIBITING DIPEPTIDYL PEPTIDASE IV Sanwa Kagaku Kenkyusho Co., Ltd. (JP) 2005-11-16 EP disclosed
WO-2005095403-A2 MACROCYCLIC COMPOUNDS AS INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. (US) 2005-10-13 WO disclosed
EP-1554243-A1 BICYCLIC BENZAMIDE COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGAND USEFUL IN THE TREATMENT OF NEUROLOGICAL DISEASES GLAXO GROUP LIMITED (GB) 2005-07-20 EP disclosed
WO-2004037788-A1 BICYCLIC BENZAMIDE COMPOUNDS AS HISTAMINE H3 RECEPTOR LIGAND USEFUL IN THE TREATMENT OF NEUROLOGICAL DISEASES GLAXO GROUP LIMITED (GB) 2004-05-06 WO disclosed
US-5869518-A USEFUL IN THE TREATMENT OF OBESITY AND HYPERGLYCEMIA SYNTHELABO (FR) 1999-02-09 US disclosed
CN-1188478-A Azacycloalcane derivatives, preparation thereof and their applications in therapy SYNTHELABO (FR) 1998-07-22 CN disclosed
EP-0823912-A1 AZACYCLOALCANE DERIVATIVES, PREPARATION THEREOF AND THEIR APPLICATIONS IN THERAPY SYNTHELABO (FR) 1998-02-18 EP disclosed
WO-1996034870-A1 AZACYCLOALCANE DERIVATIVES, PREPARATION THEREOF AND THEIR APPLICATIONS IN THERAPY SYNTHELABO (FR) 1996-11-07 WO disclosed
US-5026856-A Bactericides WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1991-06-25 US disclosed
EP-0343560-A2 Isoindoline derivative WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1989-11-29 EP 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 (5 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-20250263394-A1 COMPOUNDS, PREPARATION METHODS AND USES THEREOF PIK3CD, PIK3CA, PIK3C2B CYP1A2 3807/4885CYP2D6 2557/4885CHRNB2 4788/4885
US-20250206752-A1 PI3K INHIBITORS PIK3CA, PIK3R5, PIK3R4 CYP1A2 2039/4885CYP2D6 3496/4885CHRNB2 4329/4885
US-20250144094-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ULK1, ULK2, ULK3 CYP1A2 3561/4885CYP2D6 3877/4885CHRNB2 4752/4885
US-12281122-B1 PI3K inhibitors PIK3CA, PIK3R5, PIK3R4 CYP1A2 2039/4885CYP2D6 3496/4885CHRNB2 4329/4885
US-12624024-B2 EP2 antagonist compounds PTGER1, PTGER2, PTGER4 CYP1A2 405/4885CYP2D6 377/4885CHRNB2 265/4885

“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.