SCHEMBL9873093

SCHEMBL9873093

CC#Cc1cc(C)nc(N/N=C(/C)c2ccccc2Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 5/20 0.41
HTT P42858 4/20 0.41
LMNA P02545 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 6/20 0.41
RAB9A P51151 3/20 0.41
POLB P06746 3/20 0.41
NPC1 O15118 1/20 0.39
CYP3A4 P08684 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MDM4 O15151 1/20 0.38
MDM2 Q00987 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TP53 P04637 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
SCHEMBL9873095 1.00 MEN1 (0.44) MEN1KMT2AGAAHTTLMNA
SCHEMBL9871789 0.88 MEN1 (0.45) MEN1KMT2AGAAHTTLMNA
SCHEMBL9872244 0.77 MEN1 (0.46) MEN1KMT2AGAAHTTLMNA
SCHEMBL9872248 0.77 MEN1 (0.46) MEN1KMT2AGAAHTTLMNA
Ferimzone SCHEMBL674027 0.73 LMNA (0.56) MEN1KMT2AGAAHTTLMNA
Ferimzone SCHEMBL29733683 0.73 LMNA (0.56) MEN1KMT2AGAAHTTLMNA
Ferimzone SCHEMBL22255 0.73 LMNA (0.56) MEN1KMT2AGAAHTTLMNA
Ferimzone SCHEMBL674026 0.73 LMNA (0.56) MEN1KMT2AGAAHTTLMNA
SCHEMBL11154087 0.69 LMNA (0.51) MEN1KMT2AGAAHTTLMNA
SCHEMBL11154086 0.69 LMNA (0.51) MEN1KMT2AGAAHTTLMNA

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-5010082-A Fungicides, microbiocides CIBA-GEIGY CORPORATION (US) 1991-04-23 US disclosed