SCHEMBL6139748

SCHEMBL6139748

C#Cc1ccc(Br)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPT P10636 2/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CA14 Q9ULX7 2/20 0.34
CA4 P22748 1/20 0.34
AHR P35869 2/20 0.33
NPC1 O15118 2/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL6167204 0.78 CA12 (0.38) MEN1KMT2ACA12CA1CA2
SCHEMBL2236921 0.78 AHR (0.43) LMNAAHRALDH1A1TDP1HDAC8
SCHEMBL16953707 0.77 MAPT (0.35) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL29552192 0.77 VCAM1 (0.44) MEN1KMT2ACA12CA1CA2
SCHEMBL1798189 0.77 VCAM1 (0.44) MEN1KMT2ACA12CA1CA2
SCHEMBL9861993 0.74 TRPV4 (0.34) MEN1KMT2ACA12CA1CA2
SCHEMBL27511580 0.74 MAPT (0.33) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL1129232 0.73 KDM1A (0.37) CA12CA1CA2CA9CA14
SCHEMBL11235345 0.73 CYP3A4 (0.46) MAPTHDAC8
SCHEMBL3379669 0.73 TSHR (0.50) SMN1; SMN2HPGDALOX15CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1196403-B1 ANTIPSYCHOTIC CYCLIC N-ARALKYL AMINES SANOFI AVENTIS (FR) 2005-11-09 EP disclosed
CN-1210250-C Benzene derivatives, preparation method and pharmaceutical compositions containing same SANOFI SYNTHELABO (FR) 2005-07-13 CN disclosed
US-6908914-B1 Antipsychotic cyclic N-aralkylamines SANOFI-SYNTHELABO (FR) 2005-06-21 US disclosed
EP-1192122-B1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI SYNTHELABO (FR) 2003-10-22 EP disclosed
US-6482986-B1 Benzene derivatives, preparation method and pharmaceutical compositions containing same SANOFI-SYNTHELABO (FR) 2002-11-19 US disclosed
CN-1355782-A Benzene derivatives, preparation method and pharmaceutical compositions containing same SANOFI SYNTHELABO (FR) 2002-06-26 CN disclosed
EP-1196403-A1 ANTIPSYCHOTIC CYCLIC N-ARALKYL AMINES Sanofi-Aventis (FR) 2002-04-17 EP disclosed
EP-1192122-A1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2002-04-03 EP disclosed
WO-2001002380-A1 ANTIPSYCHOTIC CYCLIC N-ARALKYL AMINES SANOFI-SYNTHELABO (FR) 2001-01-11 WO disclosed
WO-2000076953-A1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2000-12-21 WO disclosed