SCHEMBL30385607

SCHEMBL30385607

NC(=O)NNC(=O)c1ccccc1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.55
MAPT P10636 4/20 0.55
KMT2A Q03164 2/20 0.55
GAA P10253 3/20 0.53
POLB P06746 2/20 0.53
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ALDH1A1 P00352 7/20 0.52
HSD17B10 Q99714 2/20 0.52
CFTR P13569 1/20 0.52
CA1 P00915 1/20 0.52
CA9 Q16790 1/20 0.52
FADS1 O60427 1/20 0.50
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
HPGD P15428 3/20 0.47
PTGS1 P23219 1/20 0.47
P2RX1 P51575 1/20 0.46

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
SCHEMBL9921278 0.94 KDM4E (0.60) KDM4EMAPTKMT2AGAAPOLB
SCHEMBL7729391 0.88 CA1 (0.68) KDM4EMAPTKMT2AGAAPOLB
SCHEMBL6366964 0.84 ALDH1A1 (0.53) KDM4EMAPTKMT2AGAAPOLB
SCHEMBL5574637 0.83 FADS1 (0.54) KDM4EMAPTKMT2AGAAPOLB
SCHEMBL9254644 0.82 ALDH1A1 (0.55) KDM4EMAPTKMT2AGAAPOLB
SCHEMBL18211672 0.80 KDM4E (0.49) KDM4EMAPTKMT2AGAAPOLB
SCHEMBL6636585 0.79 CA1 (0.79) KDM4EMAPTKMT2AGAAALDH1A1
SCHEMBL11743614 0.79 NPC1 (0.72) KDM4EGAAMAPK1ALDH1A1HSD17B10
SCHEMBL297624 0.78 KDM4E (0.59) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL112991 0.78 ALDH1A1 (0.55) KDM4EMAPTKMT2AGAATDP1

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-116981671-A 7-oxa-3, 4-diazabicyclo [4.1.0] hept-4-en-2-one compounds and herbicides 日本曹达株式会社 2023-10-31 CN disclosed
CN-116096696-A Compositions, agrochemicals, methods for increasing water and nutrient availability and improving pest control in plants and seeds, and uses of said compositions and said agrochemicals 奥克西泰诺工业和贸易公司 2023-05-09 CN disclosed