SCHEMBL10959900

SCHEMBL10959900

CCC(=S)Nc1ccc(-n2nnnc2S)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.41
▸ MEN1 O00255 6/20 0.41
▸ ATM Q13315 1/20 0.37
▸ ALDH1A1 P00352 7/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ PTK2 Q05397 1/20 0.34
▸ LMNA P02545 3/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ GAA P10253 3/20 0.33
▸ POLB P06746 2/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL10955673 0.89 KMT2A (0.38) KMT2AMEN1ATMALDH1A1SMN1; SMN2
SCHEMBL10955853 0.84 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL14498635 0.78 TP53 (0.51) KMT2AMEN1ATMALDH1A1SMN1; SMN2
SCHEMBL1250300 0.78 KMT2A (0.53) KMT2AMEN1ATMALDH1A1SMN1; SMN2
SCHEMBL2892873 0.76 ALDH1A1 (0.45) KMT2AMEN1ATMALDH1A1CYP1A2
SCHEMBL8045268 0.76 MAPT (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL5688069 0.75 PEPD (0.43) KMT2AMEN1ATMALDH1A1SMN1; SMN2
SCHEMBL10959896 0.75 KMT2A (0.53) KMT2AMEN1ATMALDH1A1SMN1; SMN2
SCHEMBL11108936 0.75 ALDH1A1 (0.40) KMT2AALDH1A1SMN1; SMN2LMNANPSR1
SCHEMBL9769992 0.75 PSMB11 (0.51) KMT2AMEN1ALDH1A1SMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0053851-B1 NOVEL ANTIFOGGING COMPOUNDS AND THEIR USE IN SILVER HALIDE PHOTOGRAPHY AGFA-GEVAERT N.V. (BE) 1985-05-29 — — EP disclosed
US-4451555-A 1-PHENYL-5-MERCAPTOTETRAZOLES AGFA-GEVAERT, N.V. (BE) 1984-05-29 — — US disclosed
EP-0053851-A1 Novel antifogging compounds and their use in silver halide photography AGFA-GEVAERT N.V. (BE) 1982-06-16 — — EP disclosed
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