SCHEMBL17355485

SCHEMBL17355485

CCCc1ccc(C(F)(F)Oc2ccc(-c3ccc(F)cc3)c(F)c2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.35
F2RL3 Q96RI0 2/20 0.35
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
APP P05067 1/20 0.31
CYP2C19 P33261 1/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
AR P10275 1/20 0.31
GPR3 P46089 1/20 0.30
RARB P10826 1/20 0.30

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
SCHEMBL17355444 0.91 AKR1C3 (0.39) GRM2CTSLCTSSCTSKALOX5AP
SCHEMBL17355440 0.90 ALOX5AP (0.37) GRM2CTSLCTSSCTSKALOX5AP
SCHEMBL17355550 0.90 ALOX5AP (0.37) GRM2CTSLCTSSCTSKALOX5AP
SCHEMBL17355602 0.89 CYP11B2 (0.37) GRM2ALOX5APFEN1AR
SCHEMBL17355630 0.89 CYP11B2 (0.37) GRM2ALOX5APFEN1AR
SCHEMBL17355499 0.88 CTSL (0.36) GRM2CTSLCTSSCTSKALOX5AP
SCHEMBL17377975 0.87 ALOX5AP (0.32) GRM2CTSLCTSSCTSKALOX5AP
SCHEMBL17377976 0.87 CTSL (0.33) GRM2CTSLCTSSCTSKALOX5AP
SCHEMBL17355594 0.86 ALOX5AP (0.39) GRM2F2RL3CTSLCTSSCTSK
SCHEMBL17377973 0.86 F2RL3 (0.32) F2RL3CTSLCTSSCTSKPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657229-B2 Liquid crystal compound having difluoromethyleneoxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-05-23 US disclosed
US-20150376502-A1 LIQUID CRYSTAL COMPOUND HAVING DIFLUOROMETHYLENEOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2015-12-31 US disclosed
EP-2957554-A1 LIQUID-CRYSTALLINE COMPOUND HAVING DIFLUOROMETHYLENEOXY GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2015-12-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150376502-A1 LIQUID CRYSTAL COMPOUND HAVING DIFLUOROMETHYLENEOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE C1S, CPNE4, PIEZO1 GRM2 3326/4885F2RL3 818/4885CTSL 3099/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.