SCHEMBL8136256

SCHEMBL8136256

CC(=O)NCCN1CCC(Nc2ccccn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NOS2 P35228 1/20 0.57
▸ DRD2 P14416 1/20 0.48
▸ DRD4 P21917 1/20 0.48
▸ DRD3 P35462 1/20 0.48
▸ MTNR1A P48039 2/20 0.46
▸ CARM1 Q86X55 2/20 0.46
▸ PRMT6 Q96LA8 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CCNA2 P20248 1/20 0.45
▸ CDK2 P24941 1/20 0.45
▸ OPRD1 P41143 1/20 0.44
▸ KDM1A O60341 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
SCHEMBL8145351 0.81 OGA (0.59) MEN1HTTKMT2AKDM4EGAA
SCHEMBL8142612 0.80 KDM4E (0.53) MTNR1ACARM1PRMT6KDM4EGAA
SCHEMBL1307498 0.79 NOS2 (0.54) NOS2DRD2DRD4DRD3CARM1
SCHEMBL5315582 0.79 NOS2 (0.64) NOS2DRD2DRD4DRD3MEN1
SCHEMBL12440506 0.78 NOS2 (0.62) NOS2DRD2DRD4DRD3CCNA2
SCHEMBL11777245 0.77 SIGMAR1 (0.56) NOS2DRD2DRD4DRD3GAA
Hydrochloric Acid SCHEMBL27710837 0.77 NOS2 (0.60) NOS2DRD2DRD4DRD3CCNA2
Hydrochloric Acid SCHEMBL11773957 0.76 SIGMAR1 (0.55) NOS2DRD2DRD4DRD3GAA
SCHEMBL8146680 0.76 THRB (0.55) MTNR1A
SCHEMBL13656295 0.76 NOS2 (0.56) NOS2DRD2DRD4DRD3MEN1

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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