SCHEMBL7795890

SCHEMBL7795890

CCC(=O)Nc1ccc2[nH]c(S)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
POLB P06746 2/20 0.49
CYP3A4 P08684 1/20 0.47
PDE10A Q9Y233 1/20 0.45
HPGD P15428 3/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
RAB9A P51151 7/20 0.44
CASP3 P42574 2/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
NPC1 O15118 5/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
RORC P51449 1/20 0.44
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 2/20 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
SCHEMBL7795897 0.89 MEN1 (0.50) MEN1KMT2APOLBCYP3A4HPGD
SCHEMBL7932260 0.89 MEN1 (0.53) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL8656540 0.86 SMN1; SMN2 (0.54) MEN1KMT2APOLBHPGDKDM4E
SCHEMBL7794731 0.85 SPHK2 (0.54) POLBHPGDKDM4EALDH1A1RAB9A
SCHEMBL7031470 0.85 SPHK2 (0.54) POLBHPGDKDM4EALDH1A1RAB9A
SCHEMBL6608676 0.84 KDM4E (0.55) MEN1KMT2APOLBHPGDKDM4E
SCHEMBL14093848 0.83 TERT (0.40) MEN1KMT2APOLBHPGDKDM4E
SCHEMBL13865682 0.81 FABP4 (0.49) MEN1KMT2APOLBHPGDKDM4E
SCHEMBL14160765 0.81 EGFR (0.43) MEN1KMT2APOLBHPGDKDM4E
SCHEMBL22424935 0.80 GAA (0.56) MEN1KMT2AHPGDKDM4EALDH1A1

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-0742210-B1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2001-11-21 EP disclosed
US-5962493-A HYPOLIPEMIC AGENTS; ANTICHOLESTEROL AGENTS FUJI PHOTO FILM CO., LTD. (JP) 1999-10-05 US disclosed
EP-0742210-A1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO., LTD. (JP) 1996-11-13 EP disclosed