SCHEMBL12737892

SCHEMBL12737892

CCOc1ccc(C2CCC(OC(=O)c3ccc(-c4ccc(C)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 8/20 0.39
FFAR1 O14842 4/20 0.39
CAMKK1 Q8N5S9 3/20 0.39
CAMKK2 Q96RR4 3/20 0.39
CPS1 P31327 2/20 0.36
DHODH Q02127 2/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL14766060 0.95 FFAR4 (0.43) FFAR4FFAR1CAMKK1CAMKK2CPS1
SCHEMBL12737889 0.94 CRBN (0.40) FFAR4FFAR1CAMKK1CAMKK2
SCHEMBL12737859 0.93 FFAR4 (0.39) FFAR4FFAR1CAMKK1CAMKK2CPS1
SCHEMBL12823487 0.93 CPS1 (0.41) FFAR4FFAR1CAMKK1CAMKK2CPS1
SCHEMBL12741476 0.93 CAMKK1 (0.39) FFAR4FFAR1CAMKK1CAMKK2CPS1
SCHEMBL12737895 0.92 PTPN11 (0.40) FFAR4FFAR1
SCHEMBL12737878 0.92 FFAR4 (0.38) FFAR4FFAR1CAMKK1CAMKK2CPS1
SCHEMBL12737901 0.91 PTPN11 (0.41) FFAR4FFAR1
SCHEMBL12737904 0.91 PTPN11 (0.41) FFAR4FFAR1
SCHEMBL12737911 0.91 PTPN11 (0.41) FFAR4FFAR1

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 FFAR4 546/4885FFAR1 247/4885CAMKK1 1995/4885

“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.