SCHEMBL8085208

SCHEMBL8085208

CC1(C)C=C(n2ccccc2=O)c2ccc(C(N)=S)cc2O1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.33

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
SCHEMBL7276973 0.91 F10 (0.33) F10
SCHEMBL8085330 0.90 F10 (0.40) F10
SCHEMBL7277331 0.81 F10 (0.40) F10
SCHEMBL8088448 0.81 RARA (0.32) F10
SCHEMBL8084378 0.79 ATM (0.32)
SCHEMBL8090591 0.79 F10 (0.33) F10
SCHEMBL8084382 0.78 RARA (0.32) F10
SCHEMBL8090592 0.78 RXFP1 (0.32)
SCHEMBL8088443 0.77 MAOB (0.38) F10
SCHEMBL8090551 0.77 RARA (0.41)

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-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-0273262-A2 Chroman derivatives MERCK PATENT GmbH (DE) 1988-07-06 EP disclosed