SCHEMBL11320328

SCHEMBL11320328

Cc1nc(N(C)C)sc1-c1ccc(N)c(N)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.40
▸ TDP1 Q9NUW8 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ CDK4 P11802 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ GPR52 Q9Y2T5 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ MKNK1 Q9BUB5 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ KCNH2 Q12809 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ MGAM O43451 1/20 0.34
▸ SI P14410 1/20 0.34
▸ MGAM2 Q2M2H8 1/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ CYP3A4 P08684 3/20 0.33
▸ TP53 P04637 2/20 0.33
▸ THRB P10828 1/20 0.33
▸ ALOX15 P16050 1/20 0.33

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
SCHEMBL7946068 0.81 MAPT (0.40) JAK2MEN1KMT2ACDK4CDK2
SCHEMBL14850865 0.77 NISCH (0.40) JAK2CDK4CDK2GPR52FLT3
SCHEMBL14850867 0.77 GPR52 (0.37) JAK2MEN1KMT2ACDK4CDK2
SCHEMBL7946636 0.76 ALDH1A1 (0.44) MEN1KMT2ACDK4CDK2GAA
SCHEMBL7945899 0.76 APP (0.40) MEN1KMT2AFLT3MKNK1MKNK2
SCHEMBL11160835 0.75 KMT2A (0.42) JAK2TDP1MEN1KMT2ACDK4
SCHEMBL2632547 0.75 ALDH1A1 (0.51) MEN1KMT2AGAASMN1; SMN2TP53
SCHEMBL8043074 0.74 KMT2A (0.45) MEN1KMT2ACDK4CDK2GPR52
SCHEMBL2632548 0.74 CA12 (0.42) MEN1KMT2ACDK4CDK2GPR52
SCHEMBL11000112 0.72 CDK2 (0.40) JAK2TDP1MEN1KMT2ACDK4

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-4297365-A Benzimidazoles and pharmaceutical preparations containing such compounds CIBA-GEIGY CORPORATION (US) 1981-10-27 — — US disclosed
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