SCHEMBL12734271

SCHEMBL12734271

CCCc1ccc(-c2ccc(/C=C/C3CCC(c4ccc(OCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.38
FFAR4 Q5NUL3 2/20 0.34
FPR2 P25090 1/20 0.30
NAAA Q02083 1/20 0.30
MPL P40238 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
SCHEMBL12734274 0.94 SPHK1 (0.36) KDM1AFFAR4
SCHEMBL12734270 0.93 KDM1A (0.39) KDM1AFFAR4FPR2NAAA
SCHEMBL12734282 0.92 KDM1A (0.38) KDM1AFFAR4FPR2NAAA
SCHEMBL12734286 0.90 KDM1A (0.39) KDM1AFPR2NAAA
SCHEMBL14765696 0.90 KDM1A (0.39) KDM1AFFAR4FPR2NAAA
SCHEMBL12734279 0.89 KDM1A (0.38) KDM1AFPR2NAAA
SCHEMBL14765714 0.89 KDM1A (0.37) KDM1AFFAR4FPR2NAAA
SCHEMBL12716182 0.88 KDM1A (0.38) KDM1AFPR2NAAA
SCHEMBL12734277 0.88 KDM1A (0.38) KDM1AFPR2NAAA
SCHEMBL12716819 0.87 MPL (0.32) FFAR4MPL

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 US disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 WO 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 KDM1A 937/4885FFAR4 546/4885FPR2 589/4885

“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.