SCHEMBL28690296

SCHEMBL28690296

O=Cc1ccc(N2CCN(Cc3ccoc3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 4/20 0.49
POLB P06746 2/20 0.49
HPGD P15428 1/20 0.49
TRIM24 O15164 1/20 0.49
TRIM33 Q9UPN9 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
DRD4 P21917 3/20 0.43
MAPT P10636 1/20 0.40
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39

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
SCHEMBL4392263 0.80 DRD4 (0.70) KDM4EALDH1A1HPGDTRIM24TRIM33
SCHEMBL23922755 0.77 POLB (0.63) KDM4EALDH1A1POLBTRIM24TRIM33
SCHEMBL23922857 0.75 ALDH1A1 (0.49) KDM4EALDH1A1POLBTRIM24TRIM33
SCHEMBL3077544 0.74 TRIM24 (0.83) KDM4EALDH1A1TRIM24TRIM33SMN1; SMN2
SCHEMBL2561698 0.74 TRIM24 (0.83) KDM4EALDH1A1TRIM24TRIM33SMN1; SMN2
SCHEMBL28710553 0.73 HDAC3 (0.57) KDM4EALDH1A1POLBSMN1; SMN2DRD4
SCHEMBL27990811 0.73 HRH3 (0.52) KDM4EALDH1A1POLBTRIM24TRIM33
SCHEMBL5356967 0.72 ALDH1A1 (0.66) KDM4EALDH1A1POLBTRIM24TRIM33
SCHEMBL1540225 0.72 DRD4 (0.54) KDM4EALDH1A1DRD4MAPT
SCHEMBL28694843 0.72 ALDH1A1 (0.49) KDM4EALDH1A1HPGDTRIM24TRIM33

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
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