SCHEMBL20111353

SCHEMBL20111353

Oc1cc2c(c(F)c1F)-c1c-2ccc(C2CCCC2)c1F

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 14/20 0.40
ALOX5AP P20292 13/20 0.40
PTPN5 P54829 3/20 0.34
HDAC4 P56524 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
NUDT1 P36639 1/20 0.34
BACE1 P56817 1/20 0.34
HSP90AA1 P07900 1/20 0.34
PTPN2 P17706 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
SCHEMBL20111293 0.98 FEN1 (0.42) FEN1ALOX5APPTPN5HDAC4HDAC2
SCHEMBL20111473 0.98 FEN1 (0.42) FEN1ALOX5APPTPN5HDAC4HDAC2
SCHEMBL20111695 0.97 FEN1 (0.43) FEN1ALOX5APPTPN5
SCHEMBL20111271 0.94 FEN1 (0.35) FEN1ALOX5AP
SCHEMBL20111543 0.87 ESR2 (0.36) FEN1ALOX5AP
SCHEMBL20111430 0.83 ALOX5AP (0.30) FEN1ALOX5AP
SCHEMBL20111508 0.83 ESR2 (0.33) FEN1ALOX5AP
SCHEMBL20111340 0.82
SCHEMBL20102511 0.81 FEN1 (0.36) FEN1ALOX5AP
SCHEMBL20111486 0.81 MEN1 (0.37)

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-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

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 FEN1 1547/4885ALOX5AP 2002/4885PTPN5 2145/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S FEN1 1547/4885ALOX5AP 2002/4885PTPN5 2145/4885

“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.