SCHEMBL7022344

SCHEMBL7022344

C1=C(c2ccccc2)C([Zr]C2C(c3ccccc3)=Cc3ccccc32)c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
CFTR P13569 1/20 0.31
GOPC Q9HD26 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL8022719 0.96 ALDH1A1 (0.33) ALDH1A1
Chloromethane SCHEMBL3684099 0.94 CYP11B1 (0.32) CYP19A1CYP11B1CYP11B2
SCHEMBL8022717 0.88 KMO (0.33) ALDH1A1
SCHEMBL7031934 0.87 NPC1 (0.31) ALDH1A1
SCHEMBL8026908 0.85 HTR2C (0.33) CYP11B2
SCHEMBL7025710 0.81 KIF11 (0.35)
SCHEMBL7028378 0.81 KIF11 (0.43) ALDH1A1
SCHEMBL6900110 0.81 CHRM2 (0.40) CYP11B1CYP11B2ALDH1A1
SCHEMBL7021333 0.80 TACR1 (0.33)
Biphenyl SCHEMBL7061169 0.79 KDM4E (0.36) ALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6559262-B1 An elastomeric amorphous-crystalline blocks copolymer of at least one alpha olefin monomor with ethylene having less than 10 mole % ethylene units, said ethylene is incorporated randomly between the olefin units in the polymer chain with a THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIVERSITY 2003-05-06 US disclosed
US-20010049425-A1 High-melting polyolefin copolymer elastomers, catalysts and methods of synthesis BP CORPORATION NORTH AMERICA INC. 2001-12-06 US disclosed
CN-1255928-A Catalyst system for high yield synthesis of polyolefins DOW CHEMICAL CO (US) 2000-06-07 CN disclosed
EP-0802935-A4 THERMOPLASTIC ELASTOMERIC STEREOBLOCK OLEFIN POLYMERS METHODS AND METALLOCENE CATALYSTS UNIV LELAND STANFORD JUNIOR (US) 1998-09-30 EP disclosed
EP-0802935-A1 THERMOPLASTIC ELASTOMERIC STEREOBLOCK OLEFIN POLYMERS METHODS AND METALLOCENE CATALYSTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1997-10-29 EP disclosed
WO-1995025757-A1 THERMOPLASTIC ELASTOMERIC STEREOBLOCK OLEFIN POLYMERS METHODS AND METALLOCENE CATALYSTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1995-09-28 WO disclosed