SCHEMBL2889227

SCHEMBL2889227

CC1(C)Oc2cc3nccnc3cc2C(N)C1O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 2/20 0.30
▸ CHRNA1 P02708 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ CHRNG P07510 1/20 0.30
▸ CHRNB1 P11230 1/20 0.30
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNA5 P30532 1/20 0.30
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30
▸ CHRNA7 P36544 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30
▸ HTR3A P46098 1/20 0.30
▸ CHRND Q07001 1/20 0.30
▸ CHRNA2 Q15822 1/20 0.30

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
SCHEMBL7402368 0.84 ABCC9 (0.32) ABCC9
SCHEMBL2878754 0.77 ABCC9 (0.32) ABCC9
SCHEMBL2878756 0.77 ABCC9 (0.32) ABCC9
SCHEMBL2878026 0.73 KDM4E (0.36) ABCC9
SCHEMBL9197846 0.71 HTR1A (0.39) ABCC9
SCHEMBL9197856 0.71 HTR1A (0.39) ABCC9
SCHEMBL2009843 0.71 IDO1 (0.40) ABCC9
SCHEMBL12580635 0.71 IDO1 (0.40) ABCC9
SCHEMBL9092568 0.71 MAPK1 (0.41) ABCC9
SCHEMBL9092563 0.71 MAPK1 (0.41) ABCC9

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-7652008-B2 2,2,7,9-tetramethyl-4-[(2-phenylethyl)amino]-3,4-dihydro-2H-pyrano[2,3-g]quinolin-3-ol; 3-hydroxy-2,2,9-trimethyl-4-[(2-phenylethyl)amino]-3,4-dihydro-2H-pyrano[2,3-g]quinolin-7-carbonitrile; have the prolongation effect on refractory period NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-26 — — US disclosed
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