SCHEMBL11933137

SCHEMBL11933137

CCCCOc1ccc(-c2ccc(C3=CCC(c4ccc(C)c(F)c4F)CC3)c(F)c2)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 1/20 0.34
▸ CDK9 P50750 1/20 0.34
▸ FPR2 P25090 2/20 0.31
▸ RARB P10826 1/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ SCN9A Q15858 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
SCHEMBL11933136 0.95 FPR2 (0.35) CCNT1CDK9FPR2PPARD
SCHEMBL11933152 0.94 CCNT1 (0.34) CCNT1CDK9FPR2RARBPPARD
SCHEMBL15381584 0.94 FPR2 (0.33) CCNT1CDK9FPR2PPARDSCN9A
SCHEMBL11933135 0.93 CCNT1 (0.32) CCNT1CDK9RARBSCN9A
SCHEMBL11933116 0.93 FPR2 (0.34) CCNT1CDK9FPR2
SCHEMBL18175606 0.92 FPR2 (0.37) CCNT1CDK9FPR2PPARDSCN9A
SCHEMBL12196663 0.91 SCN9A (0.30) SCN9A
SCHEMBL10301647 0.91 SCN9A (0.30) SCN9A
SCHEMBL12196505 0.91 SCN9A (0.30) SCN9A
SCHEMBL10008126 0.90 FPR2 (0.33) CCNT1CDK9FPR2PPARD

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-8580147-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-11-12 — — US disclosed
US-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-07-05 — — 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-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, OCIAD1, LEO1 CCNT1 16/4885CDK9 575/4885FPR2 804/4885

“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.

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