SCHEMBL20111478

SCHEMBL20111478

CCCc1cc2c(c(F)c1F)-c1c-2ccc(OCC2CCC(C)CC2)c1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
SCN9A Q15858 6/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
RIPK1 Q13546 1/20 0.32
BRD4 O60885 2/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30
SLC6A4 P31645 1/20 0.30
HTR6 P50406 1/20 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
SCHEMBL20111242 0.97 HPGD (0.33) HPGDSCN9AHTR2AHTR2CHTR2B
SCHEMBL20111519 0.89 HPGD (0.32) HPGDSCN9ASLC6A4HTR6
SCHEMBL20102516 0.88 RIPK1 (0.33) HTR2AHTR2CHTR2BCTSLCTSS
SCHEMBL20111705 0.86 HTR2A (0.30) HTR2AHTR2CHTR2B
SCHEMBL20102518 0.85 CTSL (0.31) CTSLCTSSCTSKRIPK1
SCHEMBL20102585 0.85 RIPK1 (0.31) RIPK1
SCHEMBL20111270 0.85 HPGD (0.36) HPGDSCN9AHTR2AHTR2CHTR2B
SCHEMBL20111285 0.85 HPGD (0.36) HPGDSCN9AHTR2AHTR2CHTR2B
SCHEMBL20117586 0.84 ALDH1A1 (0.32)
SCHEMBL20102526 0.84 CYP19A1 (0.33) HPGDSCN9ASLC6A4HTR6

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 HPGD 4744/4885SCN9A 2846/4885HTR2A 791/4885
US-10323187-B2 Liquid crystal compound having biphenylene, liquid crystal composition and liquid crystal display device YBX1, PIEZO1, C1S HPGD 4744/4885SCN9A 2846/4885HTR2A 791/4885

“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.