SCHEMBL8962310

SCHEMBL8962310

CC(CC1C=Cc2ccccc21)CC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.42
SIGMAR1 Q99720 4/20 0.36
HTR2A P28223 2/20 0.33
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
CHRM2 P08172 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
NFKB1 P19838 1/20 0.30
CHRM3 P20309 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 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
SCHEMBL5033451 0.82 HTR6 (0.45) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL5860304 0.80 HTR6 (0.49) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL5031550 0.79 HTR6 (0.43) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL9636599 0.77 HTR6 (0.46) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL30307421 0.74 HTR6 (0.44) HTR6SIGMAR1HTR2AKDM4EHSD17B10
SCHEMBL31124932 0.74 HTR6 (0.44) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL1539652 0.74 HTR6 (0.44) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL4473077 0.72 HTR6 (0.45) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL1453509 0.71 HTR6 (0.58) HTR6SIGMAR1HTR2AKDM4ELMNA
SCHEMBL671513 0.70 HTR6 (0.46) HTR6SIGMAR1HTR2AKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0500005-B1 Process for the preparation of substituted indenes HOECHST AG (DE) 1996-02-07 EP disclosed
US-5194619-A PROCESS FOR THE PREPARATION OF SUBSTITUTED INDENES HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-16 US disclosed
EP-0500005-A1 Process for the preparation of substituted indenes HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-26 EP disclosed