SCHEMBL7719938

SCHEMBL7719938

CC(C)=C1C=[C]C=C(C2c3ccccc3-c3ccccc32)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR7 P34969 1/20 0.30
HTR2B P41595 1/20 0.30
GPR3 P46089 1/20 0.30
HTR2A P28223 1/20 0.30

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
Hydrochloric Acid SCHEMBL6897416 0.72 POLB (0.32) POLBMEN1KMT2A
SCHEMBL7024410 0.59 POLB (0.37) POLBKMT2AGPR3HTR2A
SCHEMBL29116619 0.59 HTR2A (0.50) MEN1KMT2AHTR2BGPR3HTR2A
Benzene SCHEMBL27791155 0.57 LMNA (0.54) HTR2BGPR3HTR2A
SCHEMBL70993 0.57 LMNA (0.54) HTR2BGPR3HTR2A
SCHEMBL25171318 0.57 LMNA (0.54) HTR2BGPR3HTR2A
SCHEMBL29370508 0.57 LMNA (0.54) HTR2BGPR3HTR2A
SCHEMBL27885617 0.57 HTR2A (0.52) POLBMEN1KMT2AGPR3HTR2A
SCHEMBL25214731 0.56 HDAC3 (0.50) POLBMEN1KMT2AGPR3HTR2A
SCHEMBL6828591 0.56 HPGD (0.65) KMT2A

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-6403772-B1 COMPLEXES AND DERIVED CATALYSTS FOR ADDITION POLYMERIZATION, WHERE CATALYST CAN BE USED TO PREPARE POLYMER PRODUCTS WITH DESIRED PROPERTIES SUCH AS MOLECULAR WEIGHT, MOLECULAR WEIGHT DISTRIBUTION, DENSITY, TACTICITY AND TERMINAL UNSATURATION MONTELL TECHNOLOGY COMPANY, BV (NL) 2002-06-11 US disclosed