SCHEMBL20111581

SCHEMBL20111581

CCOc1ccc2c(c1F)-c1c-2cc(C2CCCCC2)c(Cl)c1F

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 12/20 0.37
PTGDR Q13258 6/20 0.37
PTGER2 P43116 1/20 0.37
APOBEC3G Q9HC16 1/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
CAMKK1 Q8N5S9 1/20 0.33
CAMKK2 Q96RR4 1/20 0.33

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
SCHEMBL20111583 0.89 PTGDR2 (0.39) PTGDR2PTGDRAPOBEC3GMAPTALDH1A1
SCHEMBL20102455 0.89 PTGDR2 (0.39) PTGDR2PTGDRAPOBEC3GMAPTALDH1A1
SCHEMBL20102450 0.88 PTGDR2 (0.37) PTGDR2PTGDRAPOBEC3GMAPTALDH1A1
SCHEMBL20102451 0.85 ALOX5AP (0.36) PTGDR2ALOX5APFEN1CAMKK1CAMKK2
SCHEMBL20102436 0.84 HPGD (0.31) MAPTHPGD
SCHEMBL20102453 0.82 KDM1A (0.36) PTGDR2APOBEC3GMAPTALDH1A1LMNA
SCHEMBL20111290 0.80 PTGDR2 (0.37) PTGDR2PTGDRAPOBEC3GMAPTALDH1A1
SCHEMBL20111344 0.80 PTGDR2 (0.32) PTGDR2PTGDRAPOBEC3GMAPTALDH1A1
SCHEMBL20111265 0.79 CAMKK1 (0.36) PTGDR2PTGDRMAPTALDH1A1LMNA
SCHEMBL20111356 0.79 FEN1 (0.38) PTGDR2MAPTALDH1A1LMNAHPGD

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 PTGDR2 1255/4885PTGDR 1618/4885PTGER2 1676/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S PTGDR2 1255/4885PTGDR 1618/4885PTGER2 1676/4885

“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.