SCHEMBL7955932

SCHEMBL7955932

CCOC(=O)c1cc2c(Cl)c(O)cc3c2n1CCCCC3=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.43
GAA P10253 3/20 0.43
ALOX15 P16050 2/20 0.43
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PDE3B Q13370 3/20 0.38
PDE3A Q14432 3/20 0.38
MAPK1 P28482 4/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 3/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL7946960 0.88 KCNK3 (0.41) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7946974 0.84 ALDH1A1 (0.37) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7958065 0.84 ALDH1A1 (0.44) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7954130 0.81 ALDH1A1 (0.45) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7946984 0.81 PDE3B (0.45) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL6801919 0.78 ALDH1A1 (0.42) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7955709 0.78 ALDH1A1 (0.42) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7955774 0.78 MAPK1 (0.43) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7946972 0.76 ALDH1A1 (0.43) ALDH1A1GAAALOX15KDM4ESMN1; SMN2
SCHEMBL7955763 0.76 ALDH1A1 (0.41) ALDH1A1GAAALOX15KDM4ESMN1; SMN2

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 4 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
US-5977100-A Substituted guanidine derivatives, process for production thereof, and pharmaceutical uses thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5834454-A TREATMENT OF ANGINA, ISCHEMIA, ARRHYTHMIA SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-11-10 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