SCHEMBL8476263

SCHEMBL8476263

O=CNCCCN1CCC(c2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.58
CARM1 Q86X55 1/20 0.58
PRMT6 Q96LA8 1/20 0.58
MEN1 O00255 1/20 0.57
TP53 P04637 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
TSHR P16473 1/20 0.57
CYP2C19 P33261 1/20 0.57
KMT2A Q03164 1/20 0.57
DRD2 P14416 3/20 0.55
SLC18A3 Q16572 2/20 0.55
ADRA1D P25100 1/20 0.53
ADRA1A P35348 1/20 0.53
ADRA1B P35368 1/20 0.53
HTR7 P34969 4/20 0.50
CHRM2 P08172 1/20 0.49
CHRM4 P08173 1/20 0.49
CHRM5 P08912 1/20 0.49

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
SCHEMBL8476000 0.81 CARM1 (0.82) SIGMAR1CARM1PRMT6MEN1TP53
SCHEMBL7463216 0.80 MCHR1 (0.60) SIGMAR1CARM1PRMT6MEN1TP53
Hydrochloric Acid SCHEMBL7259165 0.80 SIGMAR1 (0.75) SIGMAR1CARM1PRMT6MEN1TP53
SCHEMBL28442007 0.79 SIGMAR1 (0.61) SIGMAR1CARM1PRMT6MEN1TP53
Hydrochloric Acid SCHEMBL7469999 0.79 MCHR1 (0.59) SIGMAR1CARM1PRMT6MEN1TP53
SCHEMBL16273473 0.79 SIGMAR1 (0.62) SIGMAR1CARM1PRMT6MEN1TP53
SCHEMBL7382464 0.79 SIGMAR1 (0.69) SIGMAR1CARM1PRMT6MEN1TP53
SCHEMBL14587471 0.78 ADRA1D (0.63) SIGMAR1CARM1PRMT6MEN1TP53
SCHEMBL7950431 0.78 ADH1B (0.53) SIGMAR1CARM1PRMT6MEN1KMT2A
SCHEMBL7382438 0.77 SIGMAR1 (0.69) SIGMAR1CARM1PRMT6MEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6001836-A ANTAGONISTS OF NPY-INDUCED FEEDING BEHAVIOR BRISTOL-MYERS SQUIBB COMPANY (US) 1999-12-14 US disclosed
WO-1998054136-A1 DIHYDROPYRIDINE NPY ANTAGONISTS: CYANOGUANIDINE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 1998-12-03 WO disclosed