SCHEMBL10697312

SCHEMBL10697312

CC(C)c1ccccc1/C=C/C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.46
LMNA P02545 3/20 0.41
MAPT P10636 1/20 0.41
CCNC P24863 2/20 0.40
CDK8 P49336 2/20 0.40
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
NFE2L2 Q16236 3/20 0.39
NFKB1 P19838 2/20 0.39
JUN P05412 1/20 0.39
KDM4E B2RXH2 2/20 0.39
TFEB P19484 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 1/20 0.38
HSD11B1 P28845 1/20 0.38
KMT2A Q03164 1/20 0.37
FAAH O00519 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL819054 0.84 CA1 (0.56) LMNAMAPTNFKB1KDM4ECA1
SCHEMBL28414685 0.84 CA1 (0.56) LMNAMAPTNFKB1KDM4ECA1
SCHEMBL2328371 0.80 NFKB1 (0.50) PTPN1LMNAMAPTCCNCCDK8
SCHEMBL13299432 0.79 KDM4E (0.47) LMNAMAPTCCNCCDK8NFE2L2
SCHEMBL28319094 0.78 TYR (0.44) PTPN1LMNAMAPTCCNCCDK8
SCHEMBL20030395 0.77 HDAC8 (0.41) LMNAMAPTKDM4EKMT2AHPGD
SCHEMBL2010382 0.77 NOS3 (0.40) PTPN1LMNAMAPTCCNCCDK8
SCHEMBL9194659 0.76 GABRA1 (0.46) LMNAMAPTGABRA1GABRB2NFE2L2
SCHEMBL28909604 0.76 CA12 (0.49) LMNAMAPTCCNCCDK8KDM4E
SCHEMBL21716655 0.76 CA12 (0.49) LMNAMAPTCCNCCDK8KDM4E

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-0274546-A1 New oxazolinone compounds useful as intermediates for the preparation of insecticidal and acaracidal cinnamide compounds AMERICAN CYANAMID COMPANY (US) 1988-07-20 EP claimed