SCHEMBL8710433

SCHEMBL8710433

CCOc1ccc(-n2nn[nH]c2=S)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.49
NPSR1 Q6W5P4 3/20 0.49
PRNP P04156 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
ALDH1A1 P00352 6/20 0.48
KDM4E B2RXH2 4/20 0.48
HPGD P15428 3/20 0.48
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 2/20 0.48
TSHR P16473 1/20 0.48
POLB P06746 2/20 0.47
KMT2A Q03164 4/20 0.44
NQO1 P15559 1/20 0.44
MAPT P10636 4/20 0.43
GAA P10253 4/20 0.43
MEN1 O00255 3/20 0.43
RECQL P46063 1/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL1247788 0.82 HPGD (0.47) SMN1; SMN2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL12892338 0.81 NR4A1 (0.49) SMN1; SMN2ALDH1A1ALOX15TSHRPOLB
SCHEMBL1250161 0.73 KDM4E (0.46) RXFP1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6570236 0.73 MAPT (0.36) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL8049848 0.72 ALDH1A1 (0.44) SMN1; SMN2NPSR1ALDH1A1KDM4EHPGD
SCHEMBL12892330 0.72 ALDH1A1 (0.42) SMN1; SMN2NPSR1ALDH1A1KDM4EALOX15
SCHEMBL9427611 0.72 TDP1 (0.54) SMN1; SMN2NPSR1PRNPRXFP1ALDH1A1
SCHEMBL9750203 0.70 TSHR (0.50) RXFP1ALDH1A1HPGDTSHRKMT2A
SCHEMBL26126699 0.69 CACNA2D1 (0.44) SMN1; SMN2NPSR1ALDH1A1KDM4EHPGD
SCHEMBL4210492 0.68 MAPT (0.57) SMN1; SMN2NPSR1ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed