SCHEMBL8145641

SCHEMBL8145641

CC(=O)NCCN1CCN(C(C)c2ccccn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ HTR1A P08908 1/20 0.43
▸ ADRA1A P35348 1/20 0.43

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
SCHEMBL3323053 0.78 ALDH1A1 (0.45) —
SCHEMBL8146861 0.78 SLC1A2 (0.47) —
SCHEMBL3323051 0.78 CYP3A4 (0.42) KDM4EHSD17B10
SCHEMBL8146680 0.78 THRB (0.55) MTNR1A
SCHEMBL8145351 0.75 OGA (0.59) KDM4EGAA
SCHEMBL29504706 0.74 MC4R (0.56) KDM4EL3MBTL1
SCHEMBL210586 0.74 CYP1A2 (0.46) KDM4EL3MBTL1
SCHEMBL8154739 0.74 KDM4E (0.55) MTNR1AKDM4EGAAHSD17B10L3MBTL1
SCHEMBL8145105 0.73 NPSR1 (0.47) —
SCHEMBL8136256 0.72 NOS2 (0.57) MTNR1AKDM4EGAAHSD17B10L3MBTL1

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
WO-2008119741-A2 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2008-10-09 — — WO disclosed
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