SCHEMBL12733591

SCHEMBL12733591

CCCCCC1CCC(c2ccc(C3(O)CCC4(CC3)OCCO4)c(F)c2F)CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.34
OPRL1 P41146 15/20 0.34
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL742294 0.93 GPR119 (0.35) GPR119OPRL1MAPTMEN1KMT2A
SCHEMBL12733590 0.87 GPR119 (0.39) GPR119OPRL1MAPTMEN1KMT2A
SCHEMBL742285 0.85 OPRL1 (0.34) GPR119OPRL1
SCHEMBL729414 0.84 GPR119 (0.37) GPR119OPRL1MAPTMEN1KMT2A
SCHEMBL12621563 0.82 CYP3A4 (0.36) GPR119MAPTMEN1KMT2AGAA
SCHEMBL1574943 0.80 S1PR1 (0.31) OPRL1MAPTGAA
SCHEMBL1254835 0.80 CYP3A4 (0.35) GPR119MAPTMEN1KMT2AGAA
SCHEMBL742207 0.76 CYP3A4 (0.35) GPR119
SCHEMBL732013 0.75 OPRL1 (0.38) OPRL1
SCHEMBL1818096 0.74 OPRL1 (0.42) GPR119OPRL1

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 GPR119 3675/4885OPRL1 2073/4885MAPT 1075/4885

“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.