SCHEMBL1088536

SCHEMBL1088536

NC1CN(Cc2ccccc2)C1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.60
SIGMAR1 Q99720 2/20 0.58
S1PR1 P21453 1/20 0.51
S1PR5 Q9H228 1/20 0.51
DPP4 P27487 1/20 0.50
ACHE P22303 1/20 0.50
GBA1 P04062 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CCR3 P51677 1/20 0.48

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 SCHEMBL17375903 0.98 FUCA1 (0.58) FUCA1SIGMAR1S1PR1S1PR5DPP4
Hydrochloric Acid SCHEMBL1816800 0.98 FUCA1 (0.58) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL17304830 0.92 FUCA1 (0.56) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL3604123 0.92 SIGMAR1 (0.65) FUCA1SIGMAR1ACHECYP1A2CYP3A4
Hydrochloric Acid SCHEMBL17294989 0.90 FUCA1 (0.55) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL5836807 0.87 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL7575241 0.87 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL19327458 0.87 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL7372059 0.85 FUCA1 (0.46) FUCA1SIGMAR1S1PR1S1PR5ACHE
SCHEMBL42501 0.84 ACHE (0.58) SIGMAR1ACHECYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000063168-A1 SYNTHESIS OF AZETIDINE DERIVATIVES COELACANTH CHEMICAL CORPORATION (US) 2000-10-26 WO claimed
US-12391663-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS AG (CH) 2025-08-19 US disclosed
US-12384790-B2 Pteridinone compounds and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-08-12 US disclosed
US-20250161307-A1 PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE JANSSEN PHARMACEUTICA NV (BE) 2025-05-22 US disclosed
US-12240857-B2 Adamantane derivatives for the treatment of filovirus infection ARISAN THERAPEUTICS INC. (US) 2025-03-04 US disclosed
EP-4469454-A1 PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE Janssen Pharmaceutica NV (BE) 2024-12-04 EP disclosed
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MONTE ROSA THERAPEUTICS AG (CH) 2024-08-08 US disclosed
US-20240083869-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2024-03-14 US disclosed
CN-112218865-B Pteridinone compounds and uses thereof 沃泰克斯药物股份有限公司 2024-03-12 CN disclosed
US-11912682-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
US-7759336-B2 Nitrogen-containing heterocyclic compounds and medicinal use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-07-20 US disclosed
US-20100093730-A1 NOVEL COMPOUNDS AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-04-15 US disclosed
WO-2010039947-A1 NOVEL COMPOUNDS AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-04-08 WO disclosed
US-20070167459-A1 Nitrogen-containing heterocyclic compounds and medicinal use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-07-19 US disclosed
US-7157471-B2 Haloalkyl- and piperidine-substituted benzimidazole-derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-01-02 US disclosed
EP-1571146-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2005-09-07 EP disclosed
WO-2000063168-A1 SYNTHESIS OF AZETIDINE DERIVATIVES COELACANTH CHEMICAL CORPORATION (US) 2000-10-26 WO disclosed
WO-1999019297-A9 SYNTHESIS OF AZETIDINE DERIVATIVES COELACANTH CHEMICAL CORP (US) 1999-07-08 WO disclosed
WO-1999019297-A1 SYNTHESIS OF AZETIDINE DERIVATIVES COELACANTH CHEMICAL CORPORATION (US) 1999-04-22 WO disclosed
EP-0215650-B1 SUBSTITUTED BRIDGED-DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-01-29 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 (9 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-12240857-B2 Adamantane derivatives for the treatment of filovirus infection IFNAR1, MEP1B, MEP1A FUCA1 109/4885SIGMAR1 338/4885S1PR1 102/4885
US-20100093730-A1 NOVEL COMPOUNDS AS CALCIUM CHANNEL BLOCKERS CACNA1E, CACNA1S, CACNA1D FUCA1 4264/4885SIGMAR1 676/4885S1PR1 901/4885
US-12391663-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 FUCA1 2782/4885SIGMAR1 837/4885S1PR1 3365/4885
US-20240083869-A1 ISOINDOLINONE COMPOUNDS CYP4F2, AOC2, AOC3 FUCA1 2782/4885SIGMAR1 837/4885S1PR1 3365/4885
US-20070167459-A1 Nitrogen-containing heterocyclic compounds and medicinal use thereof CXCR4, CXCL12, CXCR3 FUCA1 3593/4885SIGMAR1 339/4885S1PR1 262/4885
US-11912682-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 FUCA1 2782/4885SIGMAR1 837/4885S1PR1 3365/4885
US-20250161307-A1 PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE SMOX, SRM, SMS FUCA1 2730/4885SIGMAR1 1114/4885S1PR1 71/4885
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MYC, MYCBP, GSPT1 FUCA1 2715/4885SIGMAR1 4740/4885S1PR1 3356/4885
US-12384790-B2 Pteridinone compounds and uses thereof DPYD, PKD1, TYMP FUCA1 3314/4885SIGMAR1 4583/4885S1PR1 735/4885

“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.