SCHEMBL11113364

SCHEMBL11113364

N#CCCCSc1nc2cc(Cl)ccc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.60
ALOX5 P09917 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
MEN1 O00255 3/20 0.52
MAPT P10636 3/20 0.52
KMT2A Q03164 3/20 0.52
LMNA P02545 2/20 0.52
HTT P42858 2/20 0.52
HSD17B10 Q99714 2/20 0.52
USP2 O75604 1/20 0.52
PPARA Q07869 4/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PSMD14 O00487 1/20 0.47
MMP2 P08253 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL11103532 0.83 SMN1; SMN2 (0.59) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL11115177 0.81 CYP1A2 (0.69) SMN1; SMN2MEN1MAPTKMT2ALMNA
SCHEMBL8133052 0.80 CYP1A2 (0.65) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL9439564 0.79 ALOX5 (0.64) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL9388713 0.79 ALOX5 (0.61) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL9439717 0.79 TMEM97 (0.60) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL7015882 0.78 ALOX5 (0.65) TMEM97ALOX5SMN1; SMN2MEN1MAPT
SCHEMBL10355125 0.78 ALOX5 (0.60) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL30423143 0.77 SMN1; SMN2 (0.71) TMEM97ALOX5SMN1; SMN2NPSR1MEN1
SCHEMBL9622398 0.77 SMN1; SMN2 (0.71) TMEM97ALOX5SMN1; SMN2NPSR1MEN1

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-0006347-B1 COMPOSITIONS AND METHOD FOR REGULATING SOYBEAN PLANT GROWTH UTILIZING SUBSTITUTED BENZAZOLYLTHIOALKANOIC ACIDS MONSANTO COMPANY (US) 1984-01-25 EP disclosed
EP-0006347-A1 Compositions and method for regulating soybean plant growth utilizing substituted benzazolylthioalkanoic acids MONSANTO COMPANY (US) 1980-01-09 EP disclosed