SCHEMBL7960925

SCHEMBL7960925

Cc1ccc2c3c1cc(C(=O)NC=NN)n3CCC2

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.42
HSD17B10 Q99714 3/20 0.42
ALDH1A1 P00352 2/20 0.42
USP2 O75604 1/20 0.42
MCL1 Q07820 2/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
KDM4E B2RXH2 5/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL8416150 0.97 HPGD (0.40) HPGDHSD17B10ALDH1A1USP2MCL1
SCHEMBL7955976 0.85 KMT2A (0.36) HPGDHSD17B10ALDH1A1USP2MCL1
SCHEMBL7954251 0.81 GAA (0.33) HPGDHSD17B10ALDH1A1USP2MCL1
SCHEMBL7960892 0.81
SCHEMBL7956114 0.81 MCL1 (0.57) HPGDHSD17B10ALDH1A1USP2MCL1
SCHEMBL7960922 0.80 HSD17B10 (0.41) HPGDHSD17B10ALDH1A1USP2MCL1
SCHEMBL7956081 0.79
SCHEMBL8416146 0.78 HPGD (0.38) HPGDHSD17B10ALDH1A1USP2MCL1
SCHEMBL7960930 0.78 SLC9A1 (0.30)
SCHEMBL27491189 0.78 MCL1 (0.62) HPGDHSD17B10ALDH1A1USP2MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6271251-B1 CARDIOVASCULAR DISORDERS SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2001-08-07 US disclosed
EP-0787728-A1 Substituted guanidine derivatives, process for production thereof, and pharmaceutical uses thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-08-06 EP disclosed