SCHEMBL11201281

SCHEMBL11201281

CC(C)C(=O)Nc1ccc(NN)c(C(=O)NN)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.48
▸ ALDH1A1 P00352 4/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ GLA P06280 1/20 0.46
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ KCNB1 Q14721 1/20 0.45
▸ KCNB2 Q92953 1/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ F2R P25116 1/20 0.45
▸ MAPT P10636 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ TP53 P04637 1/20 0.43
▸ GAA P10253 2/20 0.43
▸ LMNA P02545 1/20 0.43

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
SCHEMBL11202803 0.85 CA12 (0.49) KMT2AALDH1A1KDM4EGLACA12
SCHEMBL11205210 0.83 HDAC1 (0.48) KMT2AALDH1A1KDM4EGLACA12
SCHEMBL11206589 0.75 KMT2A (0.50) KMT2AALDH1A1GLAMEN1MAPT
SCHEMBL18880072 0.72 ALDH1A1 (0.73) KMT2AALDH1A1KDM4EGLACA12
SCHEMBL21367673 0.70 SMN1; SMN2 (0.58) KMT2AALDH1A1MEN1F2RMAPT
SCHEMBL13390684 0.70 KDM4C (0.57) KMT2AALDH1A1KDM4EGLACA12
SCHEMBL13883703 0.69 KMT2A (0.54) KMT2AALDH1A1KDM4EGLACA12
SCHEMBL9430771 0.69 KDM4E (0.57) KMT2AALDH1A1KDM4EGLAMEN1
SCHEMBL29793403 0.69 KCNB1 (0.59) KCNB1MAPT
SCHEMBL9313903 0.68 KMT2A (0.57) KMT2AALDH1A1KDM4EGLACA12

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-4409232-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS BEIERSDORF AKTIENGESELLSCHAFT (DE) 1983-10-11 — — US disclosed
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