SCHEMBL10754412

SCHEMBL10754412

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.50
▸ NPC1 O15118 5/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ CDK2 P24941 1/20 0.49
▸ FLT4 P35916 1/20 0.49
▸ FPR2 P25090 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ SHMT2 P34897 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ ALOX15 P16050 1/20 0.45
▸ FFAR2 O15552 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ P2RX4 Q99571 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ SORT1 Q99523 1/20 0.45
▸ PKM P14618 1/20 0.44

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
SCHEMBL10852311 0.90 CDK2 (0.52) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10753478 0.85 CDK2 (0.52) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10756947 0.83 CDK2 (0.57) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10757932 0.82 CDK2 (0.49) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10756618 0.81 RAB9A (0.54) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10756151 0.80 CDK2 (0.64) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10757666 0.80 NAMPT (0.57) RAB9ANPC1MEN1KMT2AHTT
SCHEMBL10760173 0.80 CDK2 (0.49) RAB9ANPC1MEN1KMT2ACDK2
SCHEMBL10760214 0.79 KDM4E (0.49) RAB9ANPC1MEN1KMT2AFPR2
SCHEMBL10857089 0.77 RAB9A (0.54) RAB9ANPC1MEN1KMT2ACDK2

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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