SCHEMBL18931282

SCHEMBL18931282

C=C=C/C=C\c1cccc(O)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 3/20 0.39
▸ ATM Q13315 1/20 0.39
▸ CDK4 P11802 1/20 0.38
▸ CCND1 P24385 1/20 0.38
▸ IAPP P10997 3/20 0.34
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ NFKB1 P19838 2/20 0.33
▸ CA4 P22748 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ERN1 O75460 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ POLB P06746 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ESR2 Q92731 2/20 0.31
▸ RELA Q04206 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
SCHEMBL14049586 0.80 TRPA1 (0.43) TRPA1ATMCDK4CCND1IAPP
SCHEMBL7855649 0.77 CDK4 (0.66) TRPA1ATMCDK4CCND1IAPP
SCHEMBL17266679 0.77 TRPA1 (0.43) TRPA1ATMCDK4CCND1IAPP
SCHEMBL15765152 0.74 CDK4 (0.43) TRPA1ATMCDK4CCND1IAPP
SCHEMBL18646245 0.74 CDK4 (0.43) TRPA1ATMCDK4CCND1IAPP
SCHEMBL27773602 0.74 TRPA1 (0.48) TRPA1ATMCDK4CCND1IAPP
SCHEMBL28006452 0.72 TRPA1 (0.46) TRPA1ATMCDK4CCND1IAPP
SCHEMBL14448435 0.71 IAPP (0.47) TRPA1ATMIAPPCA1CA2
SCHEMBL13176953 0.71 NFKB1 (0.47) TRPA1ATMIAPPCA1CA2
SCHEMBL196366 0.71 TRPA1 (0.50) TRPA1ATMIAPPCA1CA2

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
WO-2017094872-A1 ULTRAVIOLET ABSORBER 国立大学法人大阪大学 2017-06-08 — — WO disclosed
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