SCHEMBL12740201

SCHEMBL12740201

CCCCCC1CCC(c2ccc(C3CCC(OCc4ccc(OC)c(F)c4F)CC3)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.31
CNR2 P34972 3/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HTR1A P08908 1/20 0.31
ACHE P22303 1/20 0.30
HTR4 Q13639 1/20 0.30
TRPV1 Q8NER1 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
SCHEMBL12736590 1.00 NAAA (0.31) NAAACNR2GAAMAPTHTR1A
SCHEMBL12740206 0.92 NAAA (0.34) NAAAGAAMAPTHTR1A
SCHEMBL12736597 0.92 NAAA (0.34) NAAAGAAMAPTHTR1A
SCHEMBL12736632 0.91 NAAA (0.35) NAAA
SCHEMBL10302577 0.89 ALOX5 (0.37) NAAAHTR1A
SCHEMBL19253467 0.89 MAPT (0.36) CNR2GAAMAPTACHEHTR4
SCHEMBL9405800 0.89 MAPT (0.36) CNR2GAAMAPTACHEHTR4
SCHEMBL12733617 0.89 MAPT (0.36) CNR2GAAMAPTACHEHTR4
SCHEMBL12739660 0.88 CNR2 (0.34) CNR2GAAMAPT
SCHEMBL12734842 0.88 CNR2 (0.34) CNR2GAAMAPT

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-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

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 NAAA 3997/4885CNR2 686/4885GAA 4763/4885

“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.