SCHEMBL6187979

SCHEMBL6187979

Cc1[nH]c2ccc(NC(=O)C3=CC=CC(C)C3=S)cc2c1C(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APOBEC3G Q9HC16 1/20 0.40
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.34
JAK2 O60674 4/20 0.34
JAK1 P23458 3/20 0.34
MAOB P27338 2/20 0.34
MAPT P10636 4/20 0.33
TYK2 P29597 2/20 0.33
MAOA P21397 1/20 0.33
PTGES O14684 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
HTR1F P30939 1/20 0.32

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
SCHEMBL6189327 0.80 HPGD (0.46) KMT2AHPGDJAK2JAK1MAOB
SCHEMBL6186285 0.78 MAOA (0.49) JAK2JAK1MAOBTYK2MAOA
SCHEMBL6185134 0.77 MAOA (0.54) HPGDJAK2MAOBTYK2MAOA
SCHEMBL6187736 0.75 APOBEC3G (0.36) APOBEC3GKMT2AHPGDJAK2JAK1
SCHEMBL6185825 0.74 TYK2 (0.45) KMT2AHPGDMAPTTYK2HTT
SCHEMBL6190881 0.74 PARP1 (0.47) KMT2AHPGDJAK2JAK1MAOB
SCHEMBL6187433 0.74 MAOB (0.43) KMT2AHPGDJAK2JAK1MAOB
SCHEMBL6188852 0.73 RAB9A (0.55) KMT2AMAPTHTT
SCHEMBL6185706 0.73 MAOB (0.42) KMT2AHPGDMAOBMAPTMAOA
SCHEMBL6187153 0.72 MAOB (0.45) JAK2JAK1MAOBMAPTTYK2

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-1554271-A1 SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2005-07-20 EP disclosed
WO-2004035571-A1 SUBSTITUTED INDOLES AND THEIR USE AS HCV INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2004-04-29 WO disclosed