SCHEMBL8425581

SCHEMBL8425581

C1=CC(C/C=C/c2ccccc2)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.44
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
IDO1 P14902 2/20 0.37
PAM P19021 1/20 0.37
HTR2A P28223 4/20 0.35
KDM4E B2RXH2 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
GSTP1 P09211 1/20 0.35

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
SCHEMBL8427938 1.00 HTR6 (0.44) HTR6ALDH1A1MAPTPOLBHPGD
SCHEMBL132480 0.86 HTR6 (0.51) HTR6HTR2AKDM4ESIGMAR1
SCHEMBL7762670 0.86 HTR6 (0.51) HTR6HTR2AKDM4ESIGMAR1
SCHEMBL27516985 0.85 ALDH1A1 (0.35) HTR6ALDH1A1MAPTPOLBHPGD
SCHEMBL11576712 0.79 HTR6 (0.50) HTR6HTR2AKDM4ESIGMAR1
SCHEMBL11414399 0.79 HTR6 (0.46) HTR6HTR2AKDM4ESIGMAR1
SCHEMBL11575785 0.75 HTR6 (0.43) HTR6HTR2ASIGMAR1
SCHEMBL1779074 0.75 HTR6 (0.49) HTR6HTR2AKDM4ESIGMAR1
SCHEMBL629578 0.75 HTR6 (0.49) HTR6HTR2AKDM4ESIGMAR1
SCHEMBL292407 0.75 HTR6 (0.49) HTR6HTR2AKDM4ESIGMAR1

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-5912311-A Olefin polymerization method comprising allyl-cycloalkadienyl dianions as catalyst precursors UNIVATION TECHNOLOGIES, LLC 1999-06-15 US disclosed
US-5866497-A Catalyst for the production of olefin polymers UNIVATION TECHNOLOGIES LLC (US) 1999-02-02 US disclosed
US-5700748-A Catalyst for the production of olefin polymers comprising a bridging allyl-cyclodienyl ligand on a metal atom UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-12-23 US disclosed
CN-1157291-A Catalyst for production of olefin polymers UNION CARBIDE CHEM PLASTIC (US) 1997-08-20 CN disclosed
EP-0771777-A1 Catalyst precursor for the production of olefin polymers UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-05-07 EP disclosed