SCHEMBL6940536

SCHEMBL6940536

CC(C)(C)c1cc(C2=Cc3cc(C(C)(C)C)ccc3C2)cc(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
CYP19A1 P11511 1/20 0.37
RXRB P28702 5/20 0.33
RXRA P19793 4/20 0.33
RXRG P48443 3/20 0.33
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
GAA P10253 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
KIF11 P52732 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
SCHEMBL6280690 0.83 CYP11B1 (0.47) CYP11B1CYP11B2CYP19A1RXRBRXRA
SCHEMBL29897870 0.83 CYP11B1 (0.47) CYP11B1CYP11B2CYP19A1RXRBRXRA
SCHEMBL6939426 0.83 RXRB (0.39) CYP11B1CYP11B2CYP19A1RXRBRXRA
SCHEMBL6942040 0.83 CYP11B1 (0.36) CYP11B1CYP11B2CYP19A1GAAMAPT
SCHEMBL6940199 0.80 RXRB (0.33) RXRBRXRARXRGGAAMAPT
SCHEMBL6940332 0.80 CYP11B1 (0.35) CYP11B1CYP11B2CYP19A1RXRBRXRA
SCHEMBL6938203 0.77 RXRA (0.33) CYP11B1CYP11B2CYP19A1RXRBRXRA
SCHEMBL28015474 0.72 TSHR (0.35) CYP11B1CYP11B2CYP19A1ALDH1A1MAPT
SCHEMBL6283992 0.71 CYP11B1 (0.49) CYP11B1CYP11B2CYP19A1KIF11
Hydrochloric Acid SCHEMBL6522213 0.69 ALDH1A1 (0.32) ALDH1A1HPGDALOX15HSD17B10TDP1

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-6479424-B1 FOR PRODUCING OLEFIN POLYMERS AND ESPECIALLY ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. 2002-11-12 US claimed
EP-1157047-B1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORP NORTH AMERICA INC (US) 2003-04-23 EP disclosed
US-6479424-B1 FOR PRODUCING OLEFIN POLYMERS AND ESPECIALLY ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. 2002-11-12 US disclosed
EP-1157047-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP Corporation North America Inc. (US) 2001-11-28 EP disclosed
WO-2000035975-A1 LIGANDS AND CATALYSTS FOR PRODUCING ELASTOMERIC PROPYLENE POLYMERS BP CORPORATION NORTH AMERICA INC. (US) 2000-06-22 WO disclosed