SCHEMBL10358602

SCHEMBL10358602

CC(C)(NC(N)=O)C(Sc1nc2ccccc2s1)N(Cc1ccccc1)C(=O)NCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.45
HTT P42858 3/20 0.43
ALDH1A1 P00352 3/20 0.43
ALOX5 P09917 5/20 0.42
LMNA P02545 4/20 0.40
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
RECQL P46063 1/20 0.40
HPGD P15428 3/20 0.39
ATM Q13315 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GFER P55789 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL10645293 0.72 L3MBTL1 (0.53) POLBL3MBTL1HTTALDH1A1ALOX5
SCHEMBL10643683 0.68 L3MBTL1 (0.55) POLBL3MBTL1HTTALDH1A1ALOX5
SCHEMBL10358760 0.67 ALOX5 (0.48) POLBHTTALDH1A1ALOX5LMNA
SCHEMBL10359326 0.66 ALOX5 (0.50) POLBHTTALDH1A1ALOX5LMNA
SCHEMBL10643679 0.66 HPGD (0.54) POLBL3MBTL1HTTALDH1A1ALOX5
SCHEMBL10358308 0.65 ALOX5 (0.46) POLBHTTALDH1A1ALOX5LMNA
SCHEMBL9306312 0.65 POLB (0.56) POLBL3MBTL1ALDH1A1ALOX5LMNA
SCHEMBL10358392 0.64 ALOX5 (0.50) POLBHTTALDH1A1ALOX5LMNA
SCHEMBL10643688 0.64 LMNA (0.60) POLBHTTALDH1A1ALOX5LMNA
SCHEMBL5330099 0.64 L3MBTL1 (1.00) POLBL3MBTL1ALDH1A1LMNANPC1

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
EP-0161222-B1 HETEROCYCLIC MERCAPTOCARBOXYLIC-ACID AMIDES, IMIDES AND NITRILES AS CORROSION INHIBITING AGENTS CIBA-GEIGY AG (CH) 1990-10-10 EP disclosed