SCHEMBL27344264

SCHEMBL27344264

N#Cc1ccc2sc(CCBr)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
PPARA Q07869 1/20 0.43
HDAC6 Q9UBN7 4/20 0.40
LOXL2 Q9Y4K0 1/20 0.39
APP P05067 3/20 0.37
DYRK1A Q13627 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
NPC1 O15118 2/20 0.35
MAPK1 P28482 2/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL7388135 0.88 PPARA (0.45) POLBPPARAHDAC6LOXL2APP
SCHEMBL24963247 0.81 LOXL2 (0.59) POLBPPARALOXL2APPDYRK1A
SCHEMBL507904 0.78 PPARA (0.45) POLBPPARAHDAC6LOXL2APP
SCHEMBL27281641 0.78 DYRK1A (0.44) PPARAHDAC6LOXL2DYRK1ATRPV1
SCHEMBL507628 0.77 PPARA (0.49) PPARAAPPDYRK1AGAAALDH1A1
SCHEMBL27948402 0.76 LOXL2 (0.66) PPARAHDAC6LOXL2TRPV1NPC1
SCHEMBL27399288 0.76 NPC1 (0.43) HDAC6LOXL2DYRK1ANPC1MAPK1
SCHEMBL12298168 0.72 PPARA (0.48) PPARAAPPDYRK1AGAAALDH1A1
SCHEMBL1748230 0.72 PPARA (0.48) PPARALOXL2APPDYRK1ANPC1
SCHEMBL9808445 0.72 CYP3A4 (0.51) PPARAAPPNPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1097052-C Process for prodn. of amidinoindole derivatives and salts thereof DAIICHI SEIYAKU CO (JP) 2002-12-25 CN disclosed
CN-1062865-C Process for production of amidinobenzofuran and amidionbenzothiophen derivatives and salt thereof DAIICHI SEIYAKU CO (JP) 2001-03-07 CN disclosed
CN-1049434-C Aromatic amidine derivatives and pharmaceutically acceptable salts thereof DAIICHI SEIYAKU CO (JP) 2000-02-16 CN disclosed
CN-1168885-A Process for prodn. of amidinoindole derivatives and salts thereof DAIICHI SEIYAKU CO (JP) 1997-12-31 CN disclosed
CN-1168886-A Process for production of amidinobenzofuran and amidionbenzothiophen derivatives and salt thereof DAIICHI SEIYAKU CO (JP) 1997-12-31 CN disclosed
CN-1072677-A Aromatic amidine derivative and salt thereof DAIICHI SEIYAKU CO (JP) 1993-06-02 CN disclosed