SCHEMBL10757932

SCHEMBL10757932

C#CCNC(=O)NC(=N)Nc1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 1/20 0.49
▸ FLT4 P35916 1/20 0.49
▸ HTT P42858 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ RAB9A P51151 6/20 0.47
▸ NPC1 O15118 5/20 0.47
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ATM Q13315 1/20 0.45
▸ PKM P14618 2/20 0.44
▸ AHR P35869 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HIF1A Q16665 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 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
SCHEMBL10854328 0.90 CDK2 (0.52) CDK2FLT4HTTL3MBTL1RAB9A
SCHEMBL10753478 0.85 CDK2 (0.52) CDK2FLT4L3MBTL1RAB9ANPC1
SCHEMBL10758037 0.84 MDM2 (0.46) HTTL3MBTL1RAB9AMEN1KMT2A
SCHEMBL10756947 0.83 CDK2 (0.57) CDK2FLT4L3MBTL1RAB9ANPC1
SCHEMBL10754412 0.82 RAB9A (0.50) CDK2FLT4HTTL3MBTL1RAB9A
SCHEMBL10756618 0.81 RAB9A (0.54) CDK2FLT4HTTRAB9ANPC1
SCHEMBL10756151 0.80 CDK2 (0.64) CDK2FLT4HTTRAB9ANPC1
SCHEMBL10757666 0.80 NAMPT (0.57) HTTL3MBTL1RAB9ANPC1MEN1
SCHEMBL10760173 0.80 CDK2 (0.49) CDK2FLT4HTTL3MBTL1RAB9A
SCHEMBL10758782 0.77 RAB9A (0.50) CDK2FLT4HTTL3MBTL1RAB9A

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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