SCHEMBL18135474

SCHEMBL18135474

CC(C)c1c(C#N)c(F)c(F)c(C#N)c1C(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 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
SCHEMBL11063464 0.87 TRPV4 (0.30) TRPV4
SCHEMBL21410256 0.87 KDM4E (0.30) TRPV4
SCHEMBL21410740 0.87 TRPV4 (0.30) TRPV4
SCHEMBL2723747 0.85 — —
SCHEMBL1133590 0.84 TRPV4 (0.31) TRPV4
SCHEMBL18348918 0.83 TSHR (0.33) —
SCHEMBL12304964 0.83 KDM4E (0.33) —
SCHEMBL26382425 0.80 — —
SCHEMBL13058558 0.78 HTT (0.31) —
SCHEMBL13058553 0.78 TRPV4 (0.38) TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3069392-B1 COMPOUND WITH NOVEL SIX-MEMBERED RING STRUCTURE FOR USE IN ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-08-07 — — EP disclosed
US-10374167-B2 Compound with novel six-membered ring structure for use in organic electronic devices MERCK PATENT GMBH (DE) 2019-08-06 — — US disclosed
US-20160301016-A1 COMPOUND WITH NOVEL SIX-MEMBERED RING STRUCTURE FOR USE IN ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-10-13 — — US disclosed
US-20160301016-A1 COMPOUND WITH NOVEL SIX-MEMBERED RING STRUCTURE FOR USE IN ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-10-13 — — 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-10374167-B2 Compound with novel six-membered ring structure for use in organic electronic devices OCIAD2, OCIAD1, NR1D2 TRPV4 872/4885
US-20160301016-A1 COMPOUND WITH NOVEL SIX-MEMBERED RING STRUCTURE FOR USE IN ORGANIC ELECTRONIC DEVICES OCIAD2, OCIAD1, NR1D2 TRPV4 872/4885

“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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