SCHEMBL7659214

SCHEMBL7659214

CCc1ccc2c(ccc3cc(OC(F)(F)F)ccc32)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.47
CYP2A6 P11509 1/20 0.47
PPM1A P35813 2/20 0.42
TSHR P16473 1/20 0.42
KIF11 P52732 1/20 0.41
PIM1 P11309 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GPR3 P46089 2/20 0.39
TRPV1 Q8NER1 1/20 0.38
SLC6A4 P31645 1/20 0.37
CHRM5 P08912 3/20 0.37
GRIN2B Q13224 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36

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
SCHEMBL7664905 0.89 NCEH1 (0.40) CYP1A2CYP2A6PPM1ATSHRKIF11
SCHEMBL7655968 0.86 PCSK9 (0.43) CYP1A2PPM1ATSHRKIF11PIM1
SCHEMBL7661620 0.85 PPARG (0.40) PPM1ATSHR
SCHEMBL7666312 0.84 FAAH (0.43) PPM1A
SCHEMBL7658885 0.83 L3MBTL1 (0.47) CYP1A2PPM1AKIF11ALDH1A1GPR3
SCHEMBL7665474 0.81 PPM1A (0.54) CYP1A2CYP2A6PPM1AKIF11GPR3
SCHEMBL7659967 0.81 CA12 (0.43) PPM1AKIF11
SCHEMBL7661606 0.81 CA12 (0.43) PPM1ATSHRKIF11ALDH1A1GPR3
SCHEMBL3161110 0.80 CYP1A2 (0.47) CYP1A2CYP2A6TSHRKIF11ALDH1A1
SCHEMBL3168185 0.80 CYP17A1 (0.44) CYP1A2CYP2A6TSHRKIF11PIM1

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