SCHEMBL6188852

SCHEMBL6188852

Cc1[nH]c2ccc(NC(=O)c3cccnc3)cc2c1C(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.55
NPC1 O15118 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.52
IKBKB O14920 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
HTT P42858 2/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.49
TP53 P04637 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
KCNK3 O14649 1/20 0.48
CSF1R P07333 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 2/20 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
SCHEMBL6186894 0.87 SMN1; SMN2 (0.55) RAB9ANPC1KMT2AHTTLMNA
SCHEMBL6185825 0.78 TYK2 (0.45) RAB9ANPC1MEN1KMT2AHTT
SCHEMBL6189327 0.77 HPGD (0.46) MEN1KMT2AHTTLMNAMAPT
SCHEMBL6185706 0.76 MAOB (0.42) RAB9ANPC1MEN1KMT2AHTT
SCHEMBL6188945 0.76 KMT2A (0.44) RAB9AMEN1KMT2AHTTLMNA
SCHEMBL6186285 0.76 MAOA (0.49) SMN1; SMN2ALDH1A1
SCHEMBL6185686 0.75 DAPK3 (0.48) RAB9ANPC1L3MBTL1MEN1KMT2A
SCHEMBL6185134 0.75 MAOA (0.54) LMNASMN1; SMN2ALDH1A1
SCHEMBL6186843 0.75 ALDH1A1 (0.40) RAB9AKMT2AALDH1A1TSHR
SCHEMBL6187736 0.75 APOBEC3G (0.36) RAB9ANPC1MEN1KMT2AHTT

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