SCHEMBL7185679

SCHEMBL7185679

OC1CCCCC1C1C=Cc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.42
TDO2 P48775 3/20 0.42
SLC18A3 Q16572 6/20 0.38
CYP2D6 P10635 2/20 0.31
HTR6 P50406 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL7185673 1.00 IDO1 (0.42) IDO1TDO2SLC18A3CYP2D6HTR6
SCHEMBL7185676 1.00 IDO1 (0.42) IDO1TDO2SLC18A3CYP2D6HTR6
SCHEMBL7185802 0.88 HTR2A (0.35) IDO1TDO2CYP2D6HTR6
SCHEMBL7185808 0.88 HTR2A (0.35) IDO1TDO2CYP2D6HTR6
SCHEMBL1074094 0.77 HTR2A (0.35) IDO1TDO2CYP2D6HTR6
SCHEMBL4854655 0.75 PRCP (0.38) IDO1TDO2CYP2D6HTR6SIGMAR1
SCHEMBL7605148 0.75 PRCP (0.38) IDO1TDO2CYP2D6HTR6SIGMAR1
SCHEMBL10589173 0.75 PRCP (0.38) IDO1TDO2CYP2D6HTR6SIGMAR1
SCHEMBL9808112 0.75 PRCP (0.38) IDO1TDO2CYP2D6HTR6SIGMAR1
SCHEMBL3189703 0.75

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-6562921-B1 Catalyst composition comprising a catalyst precursor compound comprising a metal selected from Groups 4, 5 and 6 of the Periodic Table of Elements and two pi -bonded aromatic ring systems linked by a bridging group, wherein the bridging group UNIVATION TECHNOLOGIES, LLC 2003-05-13 US disclosed