SCHEMBL9109490

SCHEMBL9109490

[CH2]C(C)=Cc1nccc2occc12

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 1/20 0.36
▸ TRPA1 O75762 1/20 0.35
▸ DRD1 P21728 12/20 0.35
▸ FADS1 O60427 1/20 0.33
▸ CNR2 P34972 1/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ DRD3 P35462 1/20 0.31

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
SCHEMBL9114907 0.74 HTR2C (0.38) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL29935606 0.73 HTR2C (0.40) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL9111978 0.72 FADS1 (0.38) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL9111924 0.71 HTR2C (0.36) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL9110040 0.70 HTR2C (0.36) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL18911162 0.69 HTR2C (0.37) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL9240107 0.69 HTR2C (0.35) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL9111781 0.68 HTR2C (0.36) HTR2CTRPA1DRD1FADS1CNR2
SCHEMBL18903834 0.68 HTR2C (0.34) HTR2CTRPA1DRD1FADS1HTR2A
SCHEMBL124791 0.68 CCNC (0.36) HTR2CTRPA1DRD1FADS1CNR2

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
EP-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 — — EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 — — WO disclosed
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