SCHEMBL9546333

SCHEMBL9546333

CCCCCC(C=CC1C=C(Sc2ccccc2)C(=O)C1=CCCCCCCCC(=O)OCC)OC1CCCCO1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 6/20 0.31
▸ MGLL Q99685 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
SCHEMBL9546247 0.85 TRPA1 (0.36) PRKCA
SCHEMBL9546243 0.85 TRPA1 (0.36) PRKCA
SCHEMBL9546352 0.77 NR4A2 (0.45) —
SCHEMBL9546196 0.71 PRKCA (0.36) PRKCA
SCHEMBL9546194 0.71 PRKCA (0.36) PRKCA
SCHEMBL9546316 0.70 NR4A2 (0.36) PRKCA
SCHEMBL9546322 0.70 NR4A2 (0.36) PRKCA
SCHEMBL10514313 0.70 PTGER4 (0.35) —
SCHEMBL9546104 0.67 PDE4D (0.36) PRKCA
SCHEMBL9546354 0.67 PTGER3 (0.43) PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0338796-B1 2-SUBSTITUTED-2-CYCLOPENTENONES TEIJIN LIMITED (JP) 1993-03-10 — — EP disclosed
US-5116869-A Antitumor Agents, Bone Formation Accelerator TEIJIN LIMITED (JP) 1992-05-26 — — US disclosed
EP-0338796-A2 2-Substituted-2-cyclopentenones TEIJIN LIMITED (JP) 1989-10-25 — — EP disclosed
Send feedback