SCHEMBL14387634

SCHEMBL14387634

Nc1cccc(/C=C/c2ccccc2O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 5/20 0.63
▸ MAOA P21397 1/20 0.63
▸ MAOB P27338 1/20 0.63
▸ TRPA1 O75762 1/20 0.63
▸ NPC1 O15118 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ GFER P55789 1/20 0.51
▸ KDM1A O60341 4/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.50
▸ ABL1 P00519 1/20 0.50
▸ ABCB1 P08183 1/20 0.50
▸ BCR P11274 1/20 0.50
▸ NFKB1 P19838 2/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ JUN P05412 1/20 0.43
▸ NFE2L2 Q16236 1/20 0.43
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ CA4 P22748 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
SCHEMBL2775447 0.81 CYP19A1 (0.68) CYP19A1MAOAMAOBTRPA1NPC1
SCHEMBL2775445 0.81 CYP19A1 (0.68) CYP19A1MAOAMAOBTRPA1NPC1
SCHEMBL9419865 0.81 TRPA1 (0.68) MAOAMAOBTRPA1NPC1KDM1A
SCHEMBL9419867 0.81 TRPA1 (0.68) MAOAMAOBTRPA1NPC1KDM1A
Potassium SCHEMBL9419818 0.81 TRPA1 (0.95) TRPA1MAPTABL1ABCB1BCR
SCHEMBL2774532 0.80 CYP19A1 (0.86) CYP19A1MAOAMAOBNPC1MAPT
SCHEMBL27518377 0.80 CYP19A1 (0.56) CYP19A1MAOAMAOBTRPA1NPC1
SCHEMBL2774526 0.80 CYP19A1 (0.86) CYP19A1MAOAMAOBNPC1MAPT
SCHEMBL29664559 0.80 CYP19A1 (0.86) CYP19A1MAOAMAOBNPC1MAPT
SCHEMBL2775800 0.78 CYP19A1 (1.00) CYP19A1MAOAMAOBNPC1MAPT

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
US-7297820-B2 Stilbene derivatives and their use for binding and imaging amyloid plaques TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2007-11-20 — — US disclosed
US-7250525-B2 Stilbene derivatives and their use for binding and imaging amyloid plaques THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2007-07-31 — — US disclosed
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