SCHEMBL10303294

SCHEMBL10303294

CCc1ccc(-c2cnc(-c3ccc(C)c(F)c3F)nc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 5/20 0.35
▸ KDM5A P29375 1/20 0.34
▸ KDM5B Q9UGL1 1/20 0.34
▸ GRIN2B Q13224 10/20 0.33
▸ ALOX5AP P20292 4/20 0.33
▸ P2RX7 Q99572 1/20 0.32
▸ NLRP3 Q96P20 1/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ MAP4K1 Q92918 1/20 0.31
▸ CTSL P07711 1/20 0.31
▸ CTSS P25774 1/20 0.31
▸ CTSK P43235 1/20 0.31

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
SCHEMBL10303291 0.89 CTSL (0.40) FEN1KDM5AKDM5BGRIN2BALOX5AP
SCHEMBL10303349 0.83 ALOX5AP (0.37) FEN1GRIN2BALOX5AP
SCHEMBL10303362 0.83 FEN1 (0.37) FEN1KDM5AKDM5BGRIN2BALOX5AP
SCHEMBL10303338 0.82 FEN1 (0.36) FEN1GRIN2BALOX5AP
SCHEMBL10302706 0.80 FEN1 (0.31) FEN1GRIN2BP2RX7
SCHEMBL10303402 0.79 FEN1 (0.35) FEN1KDM5AKDM5BGRIN2BALOX5AP
SCHEMBL8190076 0.77 P2RX7 (0.39) FEN1KDM5AKDM5BP2RX7CYP3A4
SCHEMBL10303359 0.76 GRIN2B (0.32) FEN1GRIN2BALOX5APCTSLCTSS
SCHEMBL12738802 0.76 RAB9A (0.34) CTSLCTSSCTSK
SCHEMBL4402368 0.76 CCR1 (0.33) GRIN2B

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-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 — — US disclosed
US-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 — — 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 FEN1 2927/4885KDM5A 1880/4885KDM5B 1952/4885

“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.

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