SCHEMBL28290432

SCHEMBL28290432

COCCN1CCN(c2ccc(C=O)cc2)C(C)C1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.49
DRD2 P14416 2/20 0.42
DRD4 P21917 1/20 0.42
ALDH1A1 P00352 3/20 0.40
PTGER4 P35408 1/20 0.40
DRD3 P35462 1/20 0.38
OPRM1 P35372 1/20 0.37
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
TRIM24 O15164 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ADORA2A P29274 2/20 0.35
MAP3K12 Q12852 1/20 0.35
MAOB P27338 1/20 0.34

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
SCHEMBL28289034 0.92 MAPK1 (0.47) MAPK1DRD2DRD4ALDH1A1PTGER4
SCHEMBL21551742 0.79 MAPK1 (0.47) MAPK1DRD2DRD4ALDH1A1OPRM1
SCHEMBL19057548 0.79 ALDH1A1 (0.61) DRD2ALDH1A1PTGER4KDM4EMAPT
SCHEMBL28290450 0.75 ALDH1A1 (0.49) ALDH1A1PTGER4DRD3KDM4EMAPT
SCHEMBL28703960 0.75 TRIM24 (0.55) DRD2ALDH1A1DRD3KDM4EMAPT
SCHEMBL28694827 0.72 ALDH1A1 (0.55) DRD2DRD4ALDH1A1KDM4ETRIM24
SCHEMBL28690294 0.71 ALDH1A1 (0.58) DRD2ALDH1A1DRD3KDM4ETRIM24
SCHEMBL28290449 0.71 ALDH1A1 (0.47) ALDH1A1DRD3KDM4EMAPTTRIM24
SCHEMBL23346305 0.71 MAPT (0.39) MAPK1ALDH1A1MAPTTSHR
SCHEMBL28699857 0.70 ALDH1A1 (0.56) DRD2DRD4ALDH1A1DRD3KDM4E

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
CN-109563092-B 2-phenylimidazo [4,5-B ] pyridin-7-amine derivatives useful as inhibitors of the activity of the mammalian tyrosine kinase ROR1 坎塞拉有限公司 2021-09-14 CN disclosed
CN-109563092-A It can be used as the 2- phenylimidazole of the active inhibitor of mammal tyrosine kinase ROR1 simultaneously [4,5-B] pyridine -7- amine derivative 坎塞拉有限公司 2019-04-02 CN disclosed