SCHEMBL17487763

SCHEMBL17487763

CCCc1ccc(-c2ccc(-c3ccc(CCC(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3F)c(F)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.33
S1PR3 Q99500 2/20 0.33
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
RARB P10826 3/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
MAOB P27338 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
SCHEMBL17487523 0.91 S1PR1 (0.35) S1PR1S1PR3CTSLCTSSCTSK
SCHEMBL17487381 0.89 S1PR1 (0.38) S1PR1S1PR3RARB
SCHEMBL17487612 0.87 S1PR1 (0.37) S1PR1S1PR3CTSLCTSSCTSK
SCHEMBL17487565 0.85 S1PR1 (0.34) S1PR1S1PR3
SCHEMBL17487940 0.85 CNR1 (0.32) S1PR1S1PR3CTSLCTSSCTSK
SCHEMBL17487920 0.84 S1PR1 (0.40) S1PR1S1PR3CTSLCTSSCTSK
SCHEMBL17487860 0.84 S1PR1 (0.39) S1PR1S1PR3RARBMAOB
SCHEMBL17487386 0.84 S1PR1 (0.33) S1PR1S1PR3CTSLCTSSCTSK
SCHEMBL17487584 0.84 S1PR1 (0.31) S1PR1S1PR3CTSLCTSSCTSK
SCHEMBL17487583 0.84 S1PR1 (0.31) S1PR1S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9441161-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-09-13 US disclosed
US-9441161-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-09-13 US disclosed
US-20160032187-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2016-02-04 US disclosed
US-20160032187-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2016-02-04 US 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-20160032187-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE OCIAD1, OCIAD2, PIEZO1 S1PR1 1613/4885S1PR3 1279/4885CTSL 2714/4885

“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.