SCHEMBL19366104

SCHEMBL19366104

CCn1c(C(C)C)nc(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL9692394 0.72 KDM4E (0.46) KDM4EALOX15MAPK1CASP1HSD17B10
SCHEMBL31316476 0.70 KDM4E (0.44) KDM4EALOX15MAPK1CASP1HSD17B10
Bromide SCHEMBL28944789 0.70 KDM4E (0.44) KDM4EALOX15MAPK1CASP1HSD17B10
Hydrochloric Acid SCHEMBL29027490 0.70 KDM4E (0.44) KDM4EALOX15MAPK1CASP1HSD17B10
SCHEMBL18999319 0.68 KDM4E (0.43) KDM4EALOX15MAPK1CASP1HSD17B10
SCHEMBL4291299 0.68 KDM4E (0.43) KDM4EALOX15MAPK1CASP1HSD17B10
SCHEMBL19365983 0.68 KDM4E (0.43) KDM4EALOX15MAPK1CASP1HSD17B10
SCHEMBL25026160 0.66 SMN1; SMN2 (0.36) SMN1; SMN2LMNA
SCHEMBL24767999 0.64 HSD17B10 (0.39) KDM4EALOX15MAPK1CASP1HSD17B10
SCHEMBL21730494 0.64 NLRP3 (0.57) KDM4ELMNA

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
EP-3429355-B1 SUBSTITUTED SULFONYLAMIDE FOR COMBATING ANIMAL PESTS BAYER CROPSCIENCE AG (DE) 2020-02-05 EP disclosed
WO-2017157735-A1 SUBSTITUTED SULFONYL AMIDES FOR CONTROLLING ANIMAL PESTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-09-21 WO disclosed