SCHEMBL10758782

SCHEMBL10758782

CC(C)(C)NC(=O)NC(=N)Nc1cccnc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.50
▸ NPC1 O15118 5/20 0.50
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ NAMPT P43490 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ AHR P35869 1/20 0.47
▸ HTT P42858 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ CDK2 P24941 1/20 0.46
▸ FLT4 P35916 1/20 0.46

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
SCHEMBL10857581 0.89 RAB9A (0.54) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL12156880 0.85 RAB9A (0.62) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10756618 0.84 RAB9A (0.54) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10756539 0.82 MDM2 (0.50) RAB9ANPC1MEN1KMT2ATAAR1
SCHEMBL10753478 0.81 CDK2 (0.52) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10756947 0.78 CDK2 (0.57) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10857079 0.78 RAB9A (0.57) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10757932 0.77 CDK2 (0.49) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10754412 0.77 RAB9A (0.50) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL10760214 0.76 KDM4E (0.49) RAB9ANPC1MEN1KMT2ALMNA

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-4707478-A ANTIPROTOZOA AGENTS RORER PHARMACEUTICAL CORPORATION (US) 1987-11-17 — — US disclosed
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