SCHEMBL9850945

SCHEMBL9850945

CO[SiH](OC)OC.c1ccc(C2CCN2)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.46
CHRNA4 P43681 2/20 0.46
SLC18A3 Q16572 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
PRCP P42785 1/20 0.38
TACR1 P25103 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SLC6A2 P23975 1/20 0.36
ADRA1A P35348 1/20 0.36
HTR2B P41595 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CHRNA7 P36544 1/20 0.35
DRD2 P14416 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
SCHEMBL172454 0.84 CHRNB2 (0.59) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL30298452 0.84 CHRNB2 (0.59) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL1413442 0.84 CHRNB2 (0.59) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL23199875 0.72 SLC18A3 (0.44) SLC18A3SIGMAR1DRD2
SCHEMBL20690005 0.72 CHRNB2 (0.43) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL16401685 0.71 HRH1 (0.37) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL25997962 0.71 SLC18A3 (0.57) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL6268948 0.71 SLC18A3 (0.57) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL11666588 0.71 SLC18A3 (0.52) CHRNB2CHRNA4SLC18A3SIGMAR1PRCP
SCHEMBL9850948 0.70 CHRNB2 (0.50) CHRNB2CHRNA4TACR1MEN1KMT2A

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
EP-0409411-A2 Magnetic recording medium with cured surface coating MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-01-23 EP disclosed