SCHEMBL10514865

SCHEMBL10514865

CCOC(=O)c1cnn(-c2ccncc2)c1S

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.55
RAB9A P51151 3/20 0.55
HPGD P15428 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
TSHR P16473 2/20 0.54
MAPT P10636 2/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
HTT P42858 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL3323394 0.86 ALDH1A1 (0.58) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL3599042 0.84 ALDH1A1 (0.78) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL10513861 0.84 ALDH1A1 (0.55) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL10560637 0.82 RAB9A (0.53) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL2560991 0.82 ALDH1A1 (0.53) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL21604763 0.81 TRPC1 (0.64) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL10516219 0.80 ALDH1A1 (0.54) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL10558820 0.80 RAB9A (0.55) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL10917943 0.79 RAB9A (0.52) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR
SCHEMBL26125691 0.79 ALDH1A1 (0.50) ALDH1A1RAB9AHPGDSMN1; SMN2TSHR

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-4881965-A CONTROLLING WILD OATS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1989-11-21 US disclosed
EP-0318602-A1 Pyrazolesulfonamide derivative, process for its production and herbicide containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1989-06-07 EP disclosed