SCHEMBL7660282

SCHEMBL7660282

CCc1ccc2c(c1)CCc1cc(OC(F)(F)F)ccc1-2

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.45
GPR3 P46089 5/20 0.44
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
CHRM5 P08912 5/20 0.43
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
MPO P05164 1/20 0.41
GRM2 Q14416 1/20 0.38
CES1 P23141 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
SCHEMBL7663418 0.90 GRIN2B (0.43) GRIN2BGPR3ALDH1A1TSHRCHRM5
SCHEMBL7664463 0.87 GRIN2B (0.41) GRIN2BGPR3ALDH1A1TSHRCHRM5
SCHEMBL7665238 0.86 HTR2A (0.44) GRIN2BGPR3ALDH1A1TSHRCHRM5
SCHEMBL7666383 0.85 HTR2A (0.46) GRIN2BGPR3ALDH1A1CHRM5
SCHEMBL7668645 0.84 MAOB (0.46) GRIN2BGPR3MAOBMAOA
SCHEMBL7665423 0.82 CYP1A2 (0.48) GRIN2BGPR3ALDH1A1CHRM5MPO
SCHEMBL7668487 0.82 MAOB (0.50) GRIN2BGPR3CHRM5MAOBMAOA
SCHEMBL7659968 0.82 MAOB (0.53) GRIN2BGPR3ALDH1A1MAOB
SCHEMBL7668079 0.81 GPR3 (0.58) GRIN2BGPR3CHRM5MAOBMAOA
SCHEMBL7664962 0.80 MAOB (0.51) GPR3ALDH1A1MAOB

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-6495220-B2 WITH POSITIVE DIELECTRIC ANISOTROPY AND FAVORABLE VISCOSITY; THERMAL, LIGHT AND ULTRAVIOLET STABILITY; USE IN PORTABLE TELEPHONES AND NOTEBOOK COMPUTERS CLARIANT INTERNATIONAL LTD. (CH) 2002-12-17 US disclosed
US-20010023935-A1 With positive dielectric anisotropy and favorable viscosity; thermal, light and ultraviolet stability; use in portable telephones and notebook computers CLARIANT INTERNATIONAL LTD. (CH) 2001-09-27 US disclosed