SCHEMBL7044541

SCHEMBL7044541

CCCCCCn1c(C(=O)OCOCC[Si](C)(C)C)nc(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.51
FAAH O00519 5/20 0.39
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 1/20 0.37
SMPD1 P17405 1/20 0.37
ENPP2 Q13822 1/20 0.36

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
SCHEMBL7041230 0.83 NPSR1 (0.44) CNR1NPSR1POLB
SCHEMBL4085731 0.79 CNR1 (0.60) CNR1FAAHSMPD1ENPP2
SCHEMBL4076184 0.76 DGAT1 (0.46) CNR1NPSR1
SCHEMBL4089603 0.66 KDM4E (0.40) CNR1POLBSMPD1
SCHEMBL27165995 0.64 GAA (0.60) CNR1POLBENPP2
SCHEMBL27215736 0.64 GAA (0.49) CNR1FAAHPOLBENPP2
SCHEMBL7042641 0.63 DRD2 (0.53) CNR1NPSR1
SCHEMBL7044544 0.63 PSEN1 (0.38) CNR1POLBENPP2
SCHEMBL4083512 0.63 F11 (0.42) NPSR1
SCHEMBL7047749 0.63 ALDH1A1 (0.42) NPSR1

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
WO-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 WO disclosed