SCHEMBL20220366

SCHEMBL20220366

O=C(NS(=O)(=O)c1ccc(N2CCOCC2)cc1)c1cnn2ccc(N3CCCC3)cc12

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 2/20 0.59
ALDH1A1 P00352 5/20 0.43
POLB P06746 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FLT3 P36888 3/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.40
ACLY P53396 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PIK3CA P42336 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
PKM P14618 1/20 0.39
TSHR P16473 1/20 0.39
GAA P10253 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
SCHEMBL20220482 0.86 EPHB3 (0.49) EPHB3L3MBTL1FLT3
SCHEMBL20220335 0.86 EPHB3 (0.58) EPHB3ALDH1A1POLBSMN1; SMN2L3MBTL1
SCHEMBL20220418 0.83 EPHB3 (0.54) EPHB3ALDH1A1KDM4EUSP2TSHR
SCHEMBL16291892 0.81 NTRK1 (0.52)
SCHEMBL15039745 0.81 NTRK1 (0.52)
SCHEMBL20220520 0.80 EPHB3 (0.60) EPHB3ALDH1A1FLT3KDM4EUSP2
SCHEMBL20220360 0.80 EPHB3 (0.53) EPHB3FLT3PIK3CA
SCHEMBL20220334 0.79 EPHB3 (0.59) EPHB3ALDH1A1SMN1; SMN2FLT3KDM4E
SCHEMBL19562773 0.78 EPHB3 (0.59) EPHB3ALDH1A1FLT3KDM4ETSHR
SCHEMBL20220560 0.78 EPHB3 (0.58) EPHB3ALDH1A1FLT3KDM4EUSP2

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
EP-2791138-B1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE AS TROPOMYOSIN RECEPTOR KINASE (TRK) INHIBITORS Dr Reddys Laboratories Ltd (IN) 2018-06-06 EP disclosed