SCHEMBL12740977

SCHEMBL12740977

CCCCCc1ccc(-c2ccc(-c3ccc(COc4ccc(OCC)c(F)c4)cc3)c(F)c2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.44
PPARD Q03181 7/20 0.44
RARB P10826 3/20 0.43
HRH3 Q9Y5N1 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMPD1 P17405 1/20 0.40
S1PR1 P21453 3/20 0.40
S1PR3 Q99500 2/20 0.40
PTGES O14684 1/20 0.40
RARA P10276 1/20 0.38
RARG P13631 1/20 0.38

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
SCHEMBL12741008 0.96 FFAR1 (0.44) FFAR1PPARDRARBHRH3MAPT
SCHEMBL12740524 0.93 FFAR1 (0.44) FFAR1PPARDRARBHRH3MAPT
SCHEMBL12740975 0.92 FFAR1 (0.46) FFAR1PPARDS1PR1S1PR3PTGES
SCHEMBL12740974 0.91 FFAR1 (0.44) FFAR1PPARDRARBHRH3MAPT
SCHEMBL14767010 0.91 FFAR1 (0.47) FFAR1PPARDRARBS1PR1S1PR3
SCHEMBL10302302 0.90 FFAR1 (0.39) FFAR1PPARDRARBHRH3MAPT
SCHEMBL12736561 0.90 RARB (0.47) FFAR1PPARDRARBHRH3MAPT
SCHEMBL12741003 0.89 FFAR1 (0.47) FFAR1PPARDRARBHRH3L3MBTL1
SCHEMBL12736527 0.89 RARB (0.46) FFAR1PPARDRARBMAPTRAB9A
SCHEMBL10302271 0.89 RARB (0.42) RARBMAPTRAB9AL3MBTL1SMPD1

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 FFAR1 247/4885PPARD 3762/4885RARB 2705/4885

“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.