SCHEMBL5929237

SCHEMBL5929237

C=C(CCc1cc(C(C)C)c(O)c(C(C)C)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.52
▸ GSR P00390 1/20 0.45
▸ GABRA1 P14867 5/20 0.44
▸ GABRB1 P18505 5/20 0.44
▸ GABRB2 P47870 2/20 0.44
▸ GABRA5 P31644 1/20 0.44
▸ GABRA3 P34903 1/20 0.44
▸ GABRA2 P47869 1/20 0.44
▸ GABRA4 P48169 1/20 0.44
▸ GABRA6 Q16445 1/20 0.44
▸ THRA P10827 3/20 0.43
▸ THRB P10828 3/20 0.43
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ GAA P10253 2/20 0.40
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL4328080 0.83 TRPA1 (0.61) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL9198461 0.80 TRPA1 (0.54) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL9519785 0.80 TRPA1 (0.54) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL11519193 0.78 TRPA1 (0.52) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL5423386 0.78 PTGS1 (0.43) THRATHRBCA1CA2GAA
SCHEMBL9787441 0.78 SELP (0.45) CA1CA2GAALMNAMAPT
SCHEMBL15239501 0.77 GABRA1 (0.54) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL4322717 0.75 TRPA1 (0.50) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL27261832 0.75 TRPA1 (0.50) TRPA1GSRGABRA1GABRB1GABRB2
SCHEMBL5929236 0.74 PTPN1 (0.38) THRATHRBGAALMNAMAPT

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-20060040193-A1 Organic photoreceptor, image forming apparatus, image forming method and image forming unit KONICA MINOLTA HOLDINGS, INC. (JP) 2006-02-23 — — US disclosed
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