SCHEMBL17355440

SCHEMBL17355440

CCCc1ccc(C(F)(F)Oc2ccc(-c3ccc(F)c(F)c3)c(F)c2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
GRM2 Q14416 1/20 0.33
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 2/20 0.31

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
SCHEMBL17355550 0.93 ALOX5AP (0.37) ALOX5APFEN1GRM2CTSLCTSS
SCHEMBL17355602 0.92 CYP11B2 (0.37) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL17355630 0.92 CYP11B2 (0.37) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL17365897 0.91 CTSL (0.34) ALOX5APFEN1CTSLCTSSCTSK
SCHEMBL17355431 0.91 AR (0.32) CTSLCTSSCTSK
SCHEMBL17355485 0.90 GRM2 (0.35) ALOX5APFEN1GRM2CTSLCTSS
SCHEMBL17355594 0.89 ALOX5AP (0.39) ALOX5APFEN1GRM2CTSLCTSS
SCHEMBL17355499 0.89 CTSL (0.36) ALOX5APFEN1GRM2CTSLCTSS
SCHEMBL17355555 0.89 ALOX5AP (0.34) ALOX5APFEN1GRM2AKR1C3AKR1C2
SCHEMBL18887648 0.89 ALOX5AP (0.36) ALOX5APFEN1GRM2AKR1C3AKR1C2

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 ALOX5AP 2334/4885FEN1 1742/4885GRM2 3326/4885

“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.