SCHEMBL9824910

SCHEMBL9824910

CCOC(=O)c1cc(NC(=S)N2CCCCN2)c(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
RAB9A P51151 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 2/20 0.38
BAZ2B Q9UIF8 1/20 0.38
BAZ2A Q9UIF9 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 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
SCHEMBL9764390 0.91 ALDH1A1 (0.44) ALDH1A1KMT2AKDM4ETDP1RAB9A
SCHEMBL9824581 0.83 ALDH1A1 (0.47) ALDH1A1KMT2AKDM4ETDP1RAB9A
SCHEMBL9491717 0.74 ABCC1 (0.39) ALDH1A1KMT2AKDM4ERAB9AMEN1
SCHEMBL9824287 0.73 GAA (0.37) ALDH1A1KMT2AKDM4ETDP1MEN1
SCHEMBL9824295 0.72 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1BAZ2BBAZ2A
SCHEMBL9823983 0.71 CYP4F2 (0.39) ALDH1A1KMT2AKDM4ERAB9AMEN1
SCHEMBL9419236 0.71 RAB9A (0.35) KDM4ERAB9ALMNASMN1; SMN2MAPT
SCHEMBL10698297 0.69 ALDH1A1 (0.36) ALDH1A1KMT2AKDM4ERAB9AMEN1
SCHEMBL9824017 0.69 ALDH1A1 (0.36) ALDH1A1KDM4ELMNAMAPT
SCHEMBL9770931 0.69 MAPT (0.43) ALDH1A1KMT2AKDM4ETDP1MAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273417-B1 THIADIAZABICYCLONONANE DERIVATIVES AND HERBICIDAL COMPOSITIONS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1991-08-21 EP disclosed
US-4885023-A EFFECTIVE IN LOW DOSE AGAINST PADDY FIELD, UPLAND FIELD AND PERENNIAL WEEDS; NONPHYTOTOXIC KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-12-05 US disclosed
EP-0273417-A1 Thiadiazabicyclononane derivatives and herbicidal compositions KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-07-06 EP disclosed