SCHEMBL2764614

SCHEMBL2764614

NC1C2CN(Cc3ccccc3)CC12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.56
SIGMAR1 Q99720 2/20 0.54
S1PR1 P21453 1/20 0.49
S1PR5 Q9H228 1/20 0.49
DPP4 P27487 1/20 0.48
GBA1 P04062 1/20 0.47
ACHE P22303 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CCR3 P51677 1/20 0.46

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
SCHEMBL2765256 1.00 FUCA1 (0.56) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL1574151 1.00 FUCA1 (0.56) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL4089384 0.89 FUCA1 (0.50) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL16759827 0.87 FUCA1 (0.64) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL16775256 0.87 FUCA1 (0.64) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL24893928 0.85 FUCA1 (0.46) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL19327458 0.83 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL5836807 0.83 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL7575241 0.83 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4
SCHEMBL1088536 0.83 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
EP-3147283-B1 HYDRAZINE COMPOUND AS BLOOD COAGULATION FACTOR XA INHIBITOR NORTH CHINA PHARMACEUTICAL COMPANY LTD (CN) 2022-08-17 EP disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
US-9938272-B2 Hydrazine compound as blood coagulation factor Xa inhibitor NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2018-04-10 US disclosed
US-9938272-B2 Hydrazine compound as blood coagulation factor Xa inhibitor NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2018-04-10 US disclosed
US-9938272-B2 Hydrazine compound as blood coagulation factor Xa inhibitor NORTH CHINA PHARMACEUTICAL COMPANY., LTD. (CN) 2018-04-10 US disclosed
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 US disclosed
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 US disclosed
WO-2017139697-A9 BACTERIA ENGINEERED TO TREAT DISEASES ASSOCIATED WITH HYPERAMMONEMIA SYNLOGIC, INC. (US) 2017-12-07 WO disclosed
WO-2004089898-A1 SUBSTITUTED AZABICYCLO HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2004-10-21 WO disclosed
WO-2004069835-A1 SUBSTITUTED AZABICYCLO HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2004-08-19 WO disclosed
WO-2004052857-A1 3,6-DISUBSTITUTED AZABICYCLO [3.1.0] HEXANE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2004-06-24 WO disclosed
EP-0891332-B1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER (US) 2004-03-17 EP disclosed
US-6465491-B2 NITRIC OXIDE SYNTHASE INHIBITOR; NERVOUS SYSTEM DISORDERS PFIZER INC. 2002-10-15 US disclosed
US-20010034348-A1 6-phenylpyridyl-2-amine derivatives LOWE JOHN A (US) 2001-10-25 US disclosed
US-6235747-B1 NITRIC OXIDE SYNTHASE INHIBITOR PFIZER INC. 2001-05-22 US disclosed
EP-0629189-B1 PREPARATION OF INTERMEDIATES IN THE SYNTHESIS OF QUINOLINE ANTIBIOTICS PFIZER (US) 1997-08-06 EP disclosed
US-5298629-A Intermediates in the synthesis of quinoline antibiotics PFIZER INC. (US) 1994-03-29 US disclosed
US-5256791-A Preparation of intermediates in the synthesis of quinoline antibiotics PFIZER INC. (US) 1993-10-26 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 (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-20240317705-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 FUCA1 2256/4885SIGMAR1 1660/4885S1PR1 761/4885
US-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 FUCA1 2256/4885SIGMAR1 1660/4885S1PR1 761/4885
US-20010034348-A1 6-phenylpyridyl-2-amine derivatives NOS2, NOS3, NOS1 FUCA1 4342/4885SIGMAR1 696/4885S1PR1 2095/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 FUCA1 2256/4885SIGMAR1 1660/4885S1PR1 761/4885
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 FUCA1 2221/4885SIGMAR1 1759/4885S1PR1 847/4885

“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.