SCHEMBL20111325

SCHEMBL20111325

CCCc1ccc2c(c1F)-c1c-2cc(-c2ccc(-c3ccccc3F)cc2F)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
PTPRC P08575 1/20 0.37
PTPN1 P18031 1/20 0.37
FEN1 P39748 11/20 0.36
ALOX5AP P20292 9/20 0.36
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
ICMT O60725 1/20 0.33
PDK2 Q15119 1/20 0.33
ACMSD Q8TDX5 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
SCHEMBL20117679 0.88 CTSL (0.32) CTSLCTSSCTSK
SCHEMBL20102542 0.84 RARB (0.43)
SCHEMBL20111204 0.83 CTSL (0.42) CTSLCTSSCTSK
SCHEMBL20111451 0.80 CTSL (0.41) CTSLCTSSCTSKFEN1ALOX5AP
SCHEMBL20102439 0.79 TYR (0.35) CTSLCTSSCTSK
SCHEMBL20111287 0.77 CTSL (0.36) CTSLCTSSCTSK
SCHEMBL20102440 0.74 CTSL (0.40) CTSLCTSSCTSK
SCHEMBL20111480 0.72 GRM5 (0.36) CTSLCTSSCTSK
SCHEMBL20102435 0.72 RARB (0.45)
SCHEMBL16377227 0.72 RARB (0.44) CTSLCTSSCTSK

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 CTSL 2729/4885CTSS 2436/4885CTSK 2311/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S CTSL 2729/4885CTSS 2436/4885CTSK 2311/4885

“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.