SCHEMBL6784565

SCHEMBL6784565

Clc1nnc(NN=Cc2ccccc2)cc1N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP6 Q9GZR1 7/20 0.56
SENP7 Q9BQF6 6/20 0.56
MAPT P10636 7/20 0.48
KMT2A Q03164 6/20 0.48
MEN1 O00255 5/20 0.48
SENP8 Q96LD8 5/20 0.48
RAB9A P51151 5/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
CASP3 P42574 1/20 0.48
KDM4E B2RXH2 4/20 0.45
LMNA P02545 2/20 0.45
APAF1 O14727 3/20 0.43
PPP1CA P62136 1/20 0.43
NPC1 O15118 5/20 0.43
GAA P10253 3/20 0.43
PABPC1 P11940 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NSD2 O96028 1/20 0.41

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
SCHEMBL6784562 1.00 SENP6 (0.56) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL7973961 0.85 RAB9A (0.44) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL7973963 0.85 RAB9A (0.44) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL6768929 0.79 RAB9A (0.41) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL6768931 0.79 RAB9A (0.41) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL7989236 0.74 CYP1A2 (0.48) MAPTKMT2AMEN1RAB9ASMN1; SMN2
SCHEMBL2647057 0.71 ALDH1A1 (0.39) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL11279464 0.70 RAB9A (0.72) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL11279469 0.70 RAB9A (0.72) SENP6SENP7MAPTKMT2AMEN1
SCHEMBL7987387 0.68 NPC1 (0.40) MAPTKMT2AMEN1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699859-B1 TREATMENT OF ANXIETY AND CONVULSIONS. MERCK SHARP & DOHME LTD. (GB) 2004-03-02 US disclosed