SCHEMBL11268463

SCHEMBL11268463

CCOC(=O)N1C(=O)C=C(NCc2ccccc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 2/20 0.43
PPID Q08752 1/20 0.43
NPSR1 Q6W5P4 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NSD2 O96028 1/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL11253756 0.81 MAPT (0.45) CASP3SMN1; SMN2MAPTNPSR1MEN1
SCHEMBL11254698 0.80 KDM4E (0.43) SMN1; SMN2MAPTNPSR1MEN1KMT2A
SCHEMBL11263016 0.77 ALDH1A1 (0.42) CASP3SMN1; SMN2MAPTNPSR1MEN1
SCHEMBL11260264 0.73 ALDH1A1 (0.50) CASP3SMN1; SMN2MAPTNPSR1MEN1
SCHEMBL11269692 0.71 KMT2A (0.51) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL23440027 0.70 RGS4 (0.57) CASP3MAPTNPSR1MEN1KMT2A
SCHEMBL11254861 0.69 CHRM2 (0.44) SMN1; SMN2MAPTNPSR1MEN1KMT2A
SCHEMBL11263457 0.68 CASP3 (0.45) CASP3ALDH1A1LMNAKDM4EPOLB
SCHEMBL31681335 0.68 ALDH1A1 (0.62) CASP3SMN1; SMN2MAPTNPSR1MEN1
SCHEMBL18942766 0.67 GSK3A (0.40) MAPTNPSR1MEN1KMT2AALDH1A1

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