SCHEMBL11250906

SCHEMBL11250906

CC(=O)N1C(=O)C=C(Nc2ccccc2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
POLB P06746 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 2/20 0.41
IDO1 P14902 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CASP3 P42574 2/20 0.39
SENP7 Q9BQF6 2/20 0.39
HSP90AA1 P07900 2/20 0.39
NFKB1 P19838 1/20 0.39
MAPK1 P28482 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 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
SCHEMBL11257093 0.83 MAPK13 (0.42) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL11253756 0.81 MAPT (0.45) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL13318454 0.76 ALDH1A1 (0.66) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL9326699 0.71 MEN1 (0.66) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL11260264 0.69 ALDH1A1 (0.50) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL9326744 0.68 NPC1 (0.43) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
Diphenylamine SCHEMBL28553827 0.68 MAPT (0.71) MAPTPOLBNPC1RAB9AALDH1A1
Diphenylamine SCHEMBL374606 0.68 MAPT (0.71) MAPTPOLBNPC1RAB9AALDH1A1
Diphenylamine SCHEMBL6904395 0.68 MAPT (0.71) MAPTPOLBNPC1RAB9AALDH1A1
SCHEMBL24437356 0.67 KMT2A (0.58) MAPTNPC1RAB9AALDH1A1SMN1; SMN2

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
US-4353734-A PRE- AND POSTEMERGENCE CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) 1982-10-12 US claimed
US-4353734-A PRE- AND POSTEMERGENCE CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA R.T. (HU) 1982-10-12 US disclosed