SCHEMBL6660943

SCHEMBL6660943

CC1=CCC(c2cc(C(C)(C)C)cc3c2C(CC(C)(c2ccccc2)c2ccccc2)c2ccc(C(C)(C)C)cc2-3)=C1

nearest known ligand 0.31

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
SCHEMBL6656100 0.87 CYP19A1 (0.32) CYP19A1
SCHEMBL6656063 0.85 NPC1 (0.30) CYP19A1
SCHEMBL6926864 0.75 CYP19A1 (0.30) CYP19A1
SCHEMBL6926865 0.73
SCHEMBL6657516 0.68 HTR2A (0.30)
Hydrochloric Acid SCHEMBL4396009 0.67 CYP19A1 (0.32) CYP19A1
SCHEMBL6658671 0.67 CYP19A1 (0.32) CYP19A1
SCHEMBL6927913 0.65 CYP19A1 (0.30) CYP19A1
Hydrochloric Acid SCHEMBL3166797 0.65
SCHEMBL3211899 0.65 TDP1 (0.46)

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
EP-1169356-B1 POLYOLEFIN PRODUCTION ATOFINA RES (BE) 2004-07-14 EP disclosed
US-6515086-B1 A process for preparing polyolefins having a monomer length of up to C10, which comprises first contacting: (1) a metallocene catalyst component for the preparation of a polyolefin which comprises an isotactic polyolefin or FINA RESEARCH, S.A. (BE) 2003-02-04 US disclosed
EP-1169356-A1 POLYOLEFIN PRODUCTION ATOFINA Research (BE) 2002-01-09 EP disclosed
WO-2000049029-A1 POLYOLEFIN PRODUCTION FINA RESEARCH S.A. (BE) 2000-08-24 WO disclosed
WO-2000049056-A1 POLYOLEFIN PRODUCTION ATOFINA RESEARCH (BE) 2000-08-24 WO disclosed