SCHEMBL20102468

SCHEMBL20102468

CCCCCC1CCC(CCc2cc3c(c(F)c2F)-c2c-3ccc(OCC)c2F)CC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.30
KDM1A O60341 2/20 0.30
QRFPR Q96P65 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
SCHEMBL20102549 0.97
SCHEMBL20102573 0.91 RIPK1 (0.32)
SCHEMBL20117586 0.89 ALDH1A1 (0.32) KDM1AQRFPR
SCHEMBL20111248 0.89 QRFPR (0.36) HPGDKDM1AQRFPR
SCHEMBL20102471 0.88 SLC6A2 (0.32)
SCHEMBL20102516 0.88 RIPK1 (0.33)
SCHEMBL20111710 0.86 HPGD (0.33) HPGDQRFPR
SCHEMBL20102396 0.86 HTR2A (0.32) HPGDKDM1A
SCHEMBL20102585 0.85 RIPK1 (0.31)
SCHEMBL20102469 0.85

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20180119009-A1 LIQUID CRYSTAL COMPOUND HAVING BIPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE YBX1, PIEZO1, C1S HPGD 4744/4885KDM1A 1263/4885QRFPR 2307/4885

“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.