SCHEMBL6853761

SCHEMBL6853761

CCC(C)(C)C(O)(C1CC2CCC1C2)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 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
SCHEMBL75233 0.82 CYP19A1 (0.36) CYP19A1
SCHEMBL14527514 0.82 CYP19A1 (0.36) CYP19A1
SCHEMBL12332849 0.78 CYP19A1 (0.34) CYP19A1
SCHEMBL438933 0.75 CYP19A1 (0.35) CYP19A1
SCHEMBL18560088 0.75 CYP19A1 (0.35) CYP19A1
SCHEMBL12972013 0.75 CYP19A1 (0.35) CYP19A1
SCHEMBL27433178 0.75 EPHX2 (0.32) CYP19A1
SCHEMBL9945808 0.73 EPHX2 (0.31)
SCHEMBL12971937 0.73 CYP19A1 (0.36) CYP19A1
SCHEMBL17829493 0.71 CYP19A1 (0.33) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794110-B2 DEVELOPMENT OF LATENT IMAGES INTERNATIONAL BUSINESS MACHINES CORPORATION 2004-09-21 US claimed