SCHEMBL28032702

SCHEMBL28032702

NC(=O)Oc1ccc(N=C=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PRSS1 P07477 11/20 0.43
PRSS2 P07478 5/20 0.43
PRSS3 P35030 5/20 0.43
F2 P00734 4/20 0.43
KIF11 P52732 1/20 0.43
HGFAC Q04756 2/20 0.40
ACR P10323 7/20 0.38
ELANE P08246 1/20 0.38
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TMPRSS15 P98073 1/20 0.37
PLG P00747 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
SCHEMBL28822407 0.89 PRSS1 (0.39) CYP3A4TSHRMEN1KMT2APRSS1
SCHEMBL3420578 0.81 LMNA (0.53) CYP3A4TSHRMEN1KMT2AELANE
SCHEMBL3320371 0.81 CYP3A4 (0.44) CYP3A4TSHRPRSS1PRSS2PRSS3
SCHEMBL1404357 0.79 PRSS1 (0.59) PRSS1PRSS2PRSS3F2HGFAC
SCHEMBL9777755 0.79 PRSS1 (0.59) PRSS1PRSS2PRSS3F2HGFAC
SCHEMBL15708320 0.79 KMT2A (0.53) CYP3A4TSHRMEN1KMT2APRSS1
SCHEMBL8945764 0.79 PRSS1 (0.59) PRSS1PRSS2PRSS3F2HGFAC
SCHEMBL28033164 0.79 KMT2A (0.61) CYP3A4MEN1KMT2APRSS1HGFAC
SCHEMBL6284986 0.78 KMT2A (0.64) MEN1KMT2APRSS1PRSS2PRSS3
SCHEMBL632538 0.78 THRB (0.47) CYP3A4TSHRKMT2APRSS1PRSS2

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
CN-104937002-B Production formaldehyde/CO2The method of copolymer 科思创德国股份有限公司 2017-03-08 CN disclosed
CN-104937002-A Method for producing formaldehyde/CO2 copolymers BAYER MATERIALSCIENCE AG 2015-09-23 CN disclosed