SCHEMBL5779140

SCHEMBL5779140

CC(C)C(O)N1CCNCC1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP19A1 P11511 1/20 0.32
OPRD1 P41143 3/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL23547193 1.00 SMN1; SMN2 (0.36) SMN1; SMN2MEN1KMT2ACHRM5CHRM3
SCHEMBL9735269 0.85 SMN1; SMN2 (0.36) SMN1; SMN2MEN1KMT2ACHRM5CHRM3
SCHEMBL10536758 0.84 MEN1 (0.39) SMN1; SMN2MEN1KMT2ACYP2D6CYP19A1
SCHEMBL1889483 0.79
SCHEMBL13667433 0.79
SCHEMBL8373239 0.79 SMN1; SMN2 (0.38) SMN1; SMN2MEN1KMT2ACHRM5CHRM3
SCHEMBL5617 0.79
SCHEMBL28496037 0.79 MEN1 (0.37) SMN1; SMN2MEN1KMT2ACYP2D6CYP19A1
SCHEMBL11114473 0.78 SMN1; SMN2 (0.36) SMN1; SMN2MEN1KMT2ACHRM5CHRM3
Ammonia Solution, Strong SCHEMBL17509976 0.77 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2ACHRM5CHRM3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664023-A1 SUSTITUTED ISOQUINOLINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2006-06-07 EP claimed
EP-1638954-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC. (US) 2006-03-29 EP claimed
WO-2005021533-A1 SUBSTITUTED ISOQUINOLINE DERIVATIVES AND METHODS OF USE AMGEN INC (US) 2005-03-10 WO claimed
WO-2004085425-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC (US) 2004-10-07 WO claimed
EP-3327001-A1 NOVEL COMPOUND HAVING BLT INHIBITORY ACTIVITY AND COMPOSITION, FOR PREVENTING OR TREATING INFLAMMATORY DISEASES, COMPRISING SAME AS ACTIVE INGREDIENT Dongguk University Industry-Academic Cooperation Foundation (KR) 2018-05-30 EP disclosed
CN-101602741-A N-arylsulfonylheterocyamines amines as the replacement of inhibitors of gamma-secretase SCHERING CORP (US) 2009-12-16 CN disclosed
CN-101048393-A Substituted N-arylsulfonyl heterocyclic amines as gamma-secretase inhibitors SCHERING CORP (US) 2007-10-03 CN disclosed