SCHEMBL3467604

SCHEMBL3467604

Clc1cccc(/C=N/Nc2ncnc3[nH]cnc23)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.60
RAB9A P51151 8/20 0.60
MAPT P10636 7/20 0.60
KMT2A Q03164 6/20 0.60
SMN1; SMN2 Q16637 6/20 0.60
MEN1 O00255 5/20 0.60
LMNA P02545 2/20 0.51
GAA P10253 4/20 0.50
KDM4E B2RXH2 4/20 0.48
POLB P06746 2/20 0.48
HPGD P15428 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MCL1 Q07820 1/20 0.48
TDP1 Q9NUW8 1/20 0.43
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PKM P14618 1/20 0.43
XDH P47989 1/20 0.42

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
SCHEMBL3467611 1.00 NPC1 (0.60) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467332 0.85 RAB9A (0.51) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL30677376 0.85 NPC1 (0.51) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467339 0.85 RAB9A (0.51) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467469 0.85 RAB9A (0.51) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467476 0.85 RAB9A (0.51) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467058 0.85 NPC1 (0.67) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467060 0.85 NPC1 (0.67) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467763 0.84 RAB9A (0.56) NPC1RAB9AMAPTKMT2ASMN1; SMN2
SCHEMBL3467761 0.84 RAB9A (0.56) NPC1RAB9AMAPTKMT2ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010074746-A1 METHODS OF USE FOR OPSIN BINDING LIGANDS BIKAM PHARMACEUTICALS, INC. (US) 2010-07-01 WO disclosed
WO-2010074746-A1 METHODS OF USE FOR OPSIN BINDING LIGANDS BIKAM PHARMACEUTICALS, INC. (US) 2010-07-01 WO disclosed