SCHEMBL6962495

SCHEMBL6962495

N#Cc1ccccc1OC([O])=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
GAA P10253 3/20 0.47
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 5/20 0.45
TSHR P16473 2/20 0.45
HPGD P15428 1/20 0.45
POLB P06746 1/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
TP53 P04637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPK14 Q16539 1/20 0.41
NOTUM Q6P988 1/20 0.40
LPAR1 Q92633 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39

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
SCHEMBL124189 0.86 SMN1; SMN2 (0.49) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL1697190 0.84 SMN1; SMN2 (0.47) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL27689216 0.84 ALDH1A1 (0.49) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL11824600 0.82 SMN1; SMN2 (0.54) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL28656061 0.82 SMN1; SMN2 (0.46) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL5473941 0.82 PTGS2 (0.52) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL28867820 0.79 HPGD (0.54) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL6567956 0.79 KMT2A (0.58) SMN1; SMN2GAAMAPK1TSHRPOLB
SCHEMBL2639422 0.78 SMN1; SMN2 (0.46) SMN1; SMN2GAAMAPK1ALDH1A1TSHR
SCHEMBL19028127 0.78 SMN1; SMN2 (0.52) SMN1; SMN2GAAMAPK1ALDH1A1TSHR

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
EP-0426112-A1 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-05-08 EP disclosed