SCHEMBL13612412

SCHEMBL13612412

CN1CCCC(CCC(C)(C)[Si](C)(C)O)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CHRM2 P08172 2/20 0.32
ADRA2A P08913 2/20 0.32
CHRM1 P11229 2/20 0.32
DRD1 P21728 2/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
ADRA1A P35348 2/20 0.32
OPRM1 P35372 2/20 0.32
DRD3 P35462 2/20 0.32
KCNH2 Q12809 2/20 0.32
HRH3 Q9Y5N1 2/20 0.32
SIGMAR1 Q99720 2/20 0.32
ABCB11 O95342 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2B P18089 1/20 0.32
CHRM3 P20309 1/20 0.32
PTGS1 P23219 1/20 0.32

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
SCHEMBL12536229 0.79 CHRM2 (0.36) ATML3MBTL1CHRM2ADRA2ACHRM1
SCHEMBL13612416 0.75 SSTR1 (0.30)
SCHEMBL13612421 0.74 SLC6A3 (0.31) SLC6A3
SCHEMBL12594307 0.72 HRH3 (0.35) HRH3
SCHEMBL7928325 0.72
SCHEMBL1099315 0.71 BRD4 (0.41) ATML3MBTL1CHRM2ADRA2ACHRM1
SCHEMBL14535958 0.71 BRD4 (0.41) ATML3MBTL1CHRM2ADRA2ACHRM1
SCHEMBL7928330 0.70
SCHEMBL14385536 0.70
SCHEMBL23707762 0.69 DRD1 (0.39) CHRM2ADRA2ACHRM1DRD1SLC6A2

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-7635697-B2 Farnesyl protein transferase inhibitors and methods for treating proliferative diseases SCHERING CORPORATION (US) 2009-12-22 US disclosed