SCHEMBL10695954

SCHEMBL10695954

Cc1cccn2cc(Cc3ccc(OCCCCl)cc3)nc12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
MAPT P10636 4/20 0.56
NPC1 O15118 3/20 0.56
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
POLB P06746 1/20 0.56
MAPK1 P28482 1/20 0.56
HRH3 Q9Y5N1 10/20 0.52
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 2/20 0.44
PKM P14618 1/20 0.44
DRD2 P14416 1/20 0.43
DRD3 P35462 1/20 0.43

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
SCHEMBL5411356 0.81 HRH3 (0.77) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL10695952 0.79 MAPT (0.48) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL7681948 0.77 HRH3 (0.75) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL7676624 0.76 HRH3 (0.49) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL103116 0.76 RAB9A (0.61) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL7675257 0.76 HRH3 (0.73) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL10674445 0.73 HRH3 (0.71) HRH3
SCHEMBL19914857 0.71 MAPT (0.58) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL10674439 0.71 HRH3 (0.50) RAB9AMAPTNPC1ALDH1A1KDM4E
SCHEMBL9570481 0.70 RAB9A (0.61) RAB9AMAPTNPC1ALDH1A1KDM4E

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-4791117-A LOCAL ANTESTHETICS, ANTISECRETORY AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-12-13 US disclosed