SCHEMBL4028765

SCHEMBL4028765

C=CCN1CC(C(=O)c2ccccc2)C(c2cccc(C)c2C)C(C(=O)c2ccccc2)C1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 7/20 0.38
OPRK1 P41145 5/20 0.38
OPRM1 P35372 4/20 0.38
KIF11 P52732 1/20 0.35
RORC P51449 1/20 0.35

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
SCHEMBL4020978 0.88 RORC (0.40) OPRD1OPRK1OPRM1KIF11RORC
SCHEMBL4020618 0.86 KIF11 (0.41) KIF11RORC
SCHEMBL4021213 0.85 GRIN2B (0.38) KIF11RORC
SCHEMBL4021208 0.85 GRIN2B (0.38) KIF11RORC
SCHEMBL4022415 0.85 GRIN2B (0.38) KIF11RORC
SCHEMBL4780207 0.84 L3MBTL1 (0.37) KIF11RORC
SCHEMBL4772352 0.84 L3MBTL1 (0.37) KIF11RORC
SCHEMBL4776377 0.84 KCNH2 (0.42) KIF11RORC
SCHEMBL4020619 0.83 GRIN2B (0.37) KIF11RORC
SCHEMBL4772648 0.83 KIF11 (0.44) KIF11RORC

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
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
EP-1962846-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-09-03 EP disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
WO-2007059323-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-24 WO 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 OPRD1 4504/4885OPRK1 3191/4885OPRM1 4219/4885

“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.