SCHEMBL7276973

SCHEMBL7276973

CC1(C)C=C(n2ccccc2=O)c2cc(C(N)=S)ccc2O1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.33
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 1/20 0.31
PRKCI P41743 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
SCHEMBL8085208 0.91 F10 (0.33) F10
SCHEMBL7277331 0.90 F10 (0.40) F10RARARARBRARG
SCHEMBL8088448 0.90 RARA (0.32) F10RARARARBRARG
SCHEMBL8084382 0.87 RARA (0.32) F10RARARARBRARG
SCHEMBL8090551 0.86 RARA (0.41) RARARARBRARG
SCHEMBL7277136 0.86 S100A4 (0.38) F10RARARARBRARG
SCHEMBL7268034 0.83 ALOX5 (0.40) F10RARARARBRARG
SCHEMBL8088450 0.83 RARA (0.32) RARARARBRARG
SCHEMBL9796819 0.82 HRH4 (0.34)
SCHEMBL8084219 0.81 KDM4E (0.36) F10RARARARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6153627-A Chroman derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-11-28 US disclosed
US-6040308-A Chroman derivatives MERCK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-03-21 US disclosed
US-5387587-A Chroman derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-07 US disclosed
EP-0346724-A1 Chroman derivates MERCK PATENT GmbH (DE) 1989-12-20 EP disclosed
EP-0273262-A2 Chroman derivatives MERCK PATENT GmbH (DE) 1988-07-06 EP disclosed