SCHEMBL20102386

SCHEMBL20102386

CCCC1CCC(c2ccc3c(c2F)-c2c(F)cc(OCC)cc2-3)CC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CAMKK1 Q8N5S9 1/20 0.34
CAMKK2 Q96RR4 1/20 0.34
OPRL1 P41146 10/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP2C9 P11712 1/20 0.30
FFAR1 O14842 4/20 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
SCHEMBL20111294 0.87 CAMKK1 (0.35) CAMKK1CAMKK2
SCHEMBL20102395 0.85 MEN1 (0.33) OPRL1MEN1MAPK1KMT2ACYP2C9
SCHEMBL20111215 0.81 MEN1 (0.38) OPRL1MEN1MAPK1KMT2ACYP2C9
SCHEMBL20111308 0.81 ALDH1A1 (0.36) OPRL1MEN1MAPK1KMT2ACYP2C9
SCHEMBL20102486 0.79 OPRL1 (0.39) OPRL1MEN1MAPK1KMT2ACYP2C9
SCHEMBL20111486 0.78 MEN1 (0.37) OPRL1MEN1MAPK1KMT2ACYP2C9
SCHEMBL20102476 0.78 CYP2C9 (0.36) OPRL1MEN1MAPK1KMT2ACYP2C9
SCHEMBL20117671 0.78 SCN9A (0.39)
SCHEMBL20111364 0.78 ALOX5AP (0.39) OPRL1
SCHEMBL12739759 0.77 HTR2A (0.35) OPRL1MEN1KMT2AFFAR1

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-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-06-18 US disclosed
US-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-05-03 US disclosed
US-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-05-03 US disclosed
EP-3315583-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-05-02 EP 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 (2 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-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX1, PIEZO1, C1S CAMKK1 2225/4885CAMKK2 2756/4885OPRL1 1758/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S CAMKK1 2225/4885CAMKK2 2756/4885OPRL1 1758/4885

“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.