SCHEMBL7973164

SCHEMBL7973164

O=C(NCC(=O)N1CCN(CCCc2ccccc2)CC1)C1=Cc2cnc3cccc(n23)S1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 0.49
FAAH O00519 1/20 0.42
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
P2RX7 Q99572 1/20 0.40

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 SCHEMBL7983443 0.99 SIGMAR1 (0.48) SIGMAR1FAAHKDM4EALDH1A1ALOX15
SCHEMBL7971948 0.97 SIGMAR1 (0.46) SIGMAR1FAAH
Hydrochloric Acid SCHEMBL7971928 0.96 SIGMAR1 (0.45) SIGMAR1FAAHP2RX7
SCHEMBL7985583 0.90 ALDH1A1 (0.43) SIGMAR1FAAHALDH1A1
SCHEMBL7972040 0.90 SIGMAR1 (0.40) SIGMAR1FAAHKDM4EALDH1A1ALOX15
Hydrochloric Acid SCHEMBL7982606 0.89 FAAH (0.39) SIGMAR1FAAHKDM4EALDH1A1ALOX15
Hydrochloric Acid SCHEMBL7983892 0.89 ALDH1A1 (0.42) SIGMAR1FAAHALDH1A1
SCHEMBL7987161 0.87 SMYD2 (0.42) SIGMAR1FAAHKDM4EALDH1A1
Hydrochloric Acid SCHEMBL7971940 0.86 SMYD2 (0.41) SIGMAR1FAAHKDM4EALDH1A1
SCHEMBL7986015 0.85 DRD4 (0.46) SIGMAR1ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed
EP-0915888-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS Takeda Chemical Industries, Ltd. (JP) 1999-05-19 EP disclosed
WO-1997040051-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 WO disclosed