SCHEMBL7982959

SCHEMBL7982959

Cc1ccc(C(=O)Cl)c2cccnc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 8/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
KDM4A O75164 2/20 0.49
KDM4C Q9H3R0 2/20 0.49
KDM6B O15054 1/20 0.49
KDM6A O15550 1/20 0.49
TET3 O43151 1/20 0.49
KDM4B O94953 1/20 0.49
KDM5C P41229 1/20 0.49
KDM4D Q6B0I6 1/20 0.49
TET2 Q6N021 1/20 0.49
ALKBH5 Q6P6C2 1/20 0.49
TET1 Q8NFU7 1/20 0.49
FTO Q9C0B1 1/20 0.49
EGLN1 Q9GZT9 1/20 0.49
KDM2A Q9Y2K7 1/20 0.49
KDM3A Q9Y4C1 1/20 0.49

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
SCHEMBL11912045 0.85 MEN1 (0.51) MEN1KMT2ASMN1; SMN2KDM4EL3MBTL1
SCHEMBL3901228 0.85 KDM4E (0.68) MEN1KMT2ASMN1; SMN2KDM4EL3MBTL1
SCHEMBL6018142 0.81 KDM4E (0.73) MEN1KMT2ASMN1; SMN2KDM4EL3MBTL1
SCHEMBL7603841 0.80 KDM4E (0.51) MEN1KMT2ASMN1; SMN2KDM4EL3MBTL1
SCHEMBL4699764 0.80 PDE4A (0.62) MEN1KMT2AKDM4EL3MBTL1KDM4A
SCHEMBL23714061 0.78 KDM4E (0.56) MEN1KMT2ASMN1; SMN2KDM4EKDM4A
Ethane SCHEMBL27460273 0.78 PDE4A (0.61) MEN1KMT2AKDM4EL3MBTL1KDM4A
Hydrochloric Acid SCHEMBL4703616 0.78 PDE4D (0.61) MEN1KMT2AKDM4EL3MBTL1KDM4A
SCHEMBL9944372 0.77 KDM4E (0.52) MEN1KMT2ASMN1; SMN2KDM4EL3MBTL1
SCHEMBL5534805 0.77 MEN1 (0.57) MEN1KMT2ASMN1; SMN2KDM4EL3MBTL1

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
US-6262074-B1 4-Hetaroylpyrazol derivatives and the use thereof as herbicides BASF AKTIENGESELLSCHAFT (DE) 2001-07-17 US disclosed