SCHEMBL8115602

SCHEMBL8115602

Cc1[nH]ccc1C1CCNC(c2ccccc2)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
HTR2C P28335 4/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PRCP P42785 2/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SLC6A2 P23975 1/20 0.30
CHRNA7 P36544 1/20 0.30
MASP2 O00187 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
SCHEMBL8124405 0.92 MKNK1 (0.34) SLC18A3SIGMAR1HTR2C
SCHEMBL8125702 0.89 PRCP (0.33) PRCP
SCHEMBL8131062 0.86 HTR3A (0.39) PRCPSLC6A2CHRNA7
SCHEMBL8125194 0.86 SLC6A2 (0.32) PRCPSLC6A2
SCHEMBL8124794 0.84 SLC6A2 (0.36) HTR2CSLC6A2
SCHEMBL8124867 0.84 SLC6A2 (0.36) HTR2CSLC6A2
SCHEMBL8128593 0.84 SLC6A4 (0.36) HTR2CSLC6A2
SCHEMBL8131236 0.83 SLC18A3 (0.36) SLC18A3SIGMAR1MEN1KMT2ASLC6A2
SCHEMBL8126333 0.83 SLC18A3 (0.36) SLC18A3SIGMAR1MEN1KMT2A
SCHEMBL8123312 0.83 SLC18A3 (0.38) SLC18A3SIGMAR1MEN1KMT2APRCP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054887-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Amgen Inc. (US) 2000-11-29 EP claimed
WO-1999040091-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC. (US) 1999-08-12 WO claimed
EP-1054887-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Amgen Inc. (US) 2000-11-29 EP disclosed
WO-1999040091-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC. (US) 1999-08-12 WO disclosed