SCHEMBL7201527

SCHEMBL7201527

C=CCC(C)CC=Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.59
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GRIK1 P39086 2/20 0.41
GRIK2 Q13002 2/20 0.41
IDO1 P14902 2/20 0.40
PAM P19021 1/20 0.40
TSHR P16473 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL14037582 0.90 HTR2A (0.70) HTR2AGRIK1GRIK2IDO1PAM
SCHEMBL106773 0.81 HTR2A (0.63) HTR2AMEN1KMT2AGRIK1GRIK2
SCHEMBL106772 0.81 HTR2A (0.63) HTR2AMEN1KMT2AGRIK1GRIK2
SCHEMBL25189137 0.79 HTR2A (0.61) HTR2AGRIK1GRIK2IDO1PAM
SCHEMBL6435302 0.79 HTR2A (0.61) HTR2AMEN1KMT2AGRIK1GRIK2
SCHEMBL6435300 0.79 HTR2A (0.61) HTR2AMEN1KMT2AGRIK1GRIK2
SCHEMBL8826291 0.79 HTR2A (0.66) HTR2AGRIK1GRIK2IDO1PAM
SCHEMBL107852 0.78 HTR2A (0.70) HTR2AMEN1KMT2AGRIK1GRIK2
SCHEMBL107851 0.78 HTR2A (0.70) HTR2AMEN1KMT2AGRIK1GRIK2
SCHEMBL2170349 0.78 HTR2A (0.70) HTR2AMEN1KMT2AGRIK1GRIK2

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-20030134958-A1 Gelatinous elastomer compositions and articles APPLIED ELASTOMERICS, INCORPORATED 2003-07-17 US disclosed