SCHEMBL1324577

SCHEMBL1324577

CC(P)(C1CC2CCC1C2)C1CC2CCC1C2

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.32

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
SCHEMBL19865846 0.80 CYP19A1 (0.33) CYP19A1
SCHEMBL11958388 0.76 CYP19A1 (0.32) CYP19A1
SCHEMBL5194757 0.76 CYP19A1 (0.38) CYP19A1
SCHEMBL22072783 0.76 CYP19A1 (0.32) CYP19A1
SCHEMBL19454864 0.76 CYP19A1 (0.32) CYP19A1
SCHEMBL3435218 0.76 CYP19A1 (0.32) CYP19A1
SCHEMBL5194124 0.76 CYP19A1 (0.38) CYP19A1
SCHEMBL9934752 0.76 CYP19A1 (0.38) CYP19A1
SCHEMBL14707479 0.74 CYP19A1 (0.31) CYP19A1
SCHEMBL24502169 0.73 CYP19A1 (0.36) CYP19A1

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-8058382-B2 Uretdione formation in solution BAYER MATERIALSCIENCE AG (DE) 2011-11-15 US disclosed
US-20110275802-A1 METHOD FOR MODIFYING DIISOCYANATES BAYER MATERIALSCIENCE AG (DE) 2011-11-10 US disclosed
US-20060173152-A1 Uretdione formation in solution BAYER MATERIALSCIENCE AG 2006-08-03 US disclosed
US-4595701-A Reacting carbon monoxide and hydrogen in liquid phase in the presence of a rhodium and trialkylphosphine catalyst AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1986-06-17 US disclosed