SCHEMBL8763467

SCHEMBL8763467

Cc1cc(C(C)(C)C)c(O)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.48
▸ GABRA1 P14867 1/20 0.48
▸ GABRB2 P47870 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ CA2 P00918 4/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ TYR P14679 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ PKM P14618 1/20 0.46
▸ CA1 P00915 2/20 0.45
▸ PTGS1 P23219 3/20 0.44
▸ PTGS2 P35354 3/20 0.44
▸ TSHR P16473 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ HSPA5 P11021 1/20 0.40
▸ ALOX5 P09917 1/20 0.40

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
SCHEMBL887675 0.83 CA2 (0.48) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL7520146 0.82 LMNA (0.55) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL8466821 0.79 GABRA1 (0.53) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL23763396 0.79 CYP1A2 (0.44) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL6537313 0.78 CA2 (0.43) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL5663780 0.78 ERN1 (0.43) CYP1A2CA2ALDH1A1POLBTYR
SCHEMBL8772275 0.78 HSPA5 (0.47) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL9861935 0.77 CA2 (0.42) CYP1A2GABRA1GABRB2CYP2C9CYP2C19
SCHEMBL8772295 0.77 HSPA5 (0.50) CYP1A2CYP2C9CYP2C19LMNACA2
SCHEMBL9128005 0.77 CA2 (0.42) CYP1A2GABRA1GABRB2CYP2C9CYP2C19

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0605127-B1 Overcoating for multilayered organic photoreceptors containing a stabilizer and charge transport molecules XEROX CORP (US) 1997-07-02 — — EP disclosed
US-5401615-A Overcoating for multilayered organic photoreceptors containing a stabilizer and charge transport molecules XEROX CORPORATION (US) 1995-03-28 — — US disclosed
EP-0605127-A1 Overcoating for multilayered organic photoreceptors containing a stabilizer and charge transport molecules XEROX CORPORATION (US) 1994-07-06 — — EP disclosed
EP-0187013-B1 PHOTOCONDUCTIVE IMAGING MEMBER XEROX CORPORATION (US) 1991-10-16 — — EP disclosed
EP-0186303-B1 ELECTROPHOTOGRAPHIC IMAGING MEMBERS XEROX CORPORATION (US) 1989-06-07 — — EP disclosed
EP-0187013-A2 Photoconductive imaging member XEROX CORPORATION (US) 1986-07-09 — — EP disclosed
US-4599286-A ELECTROGRAPHY XEROX CORPORATION (US) 1986-07-08 — — US disclosed
EP-0186303-A1 Electrophotographic imaging members XEROX CORPORATION (US) 1986-07-02 — — EP disclosed
US-4563408-A ELECTROGRAPHY XEROX CORPORATION (US) 1986-01-07 — — US disclosed
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