SCHEMBL9233526

SCHEMBL9233526

Nn1cc(-c2ccncc2)nn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 3/20 0.50
▸ GSK3B P49841 2/20 0.50
▸ TP53 P04637 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HDAC3 O15379 4/20 0.39
▸ HDAC4 P56524 4/20 0.39
▸ HDAC1 Q13547 4/20 0.39
▸ HDAC7 Q8WUI4 4/20 0.39
▸ HDAC2 Q92769 4/20 0.39
▸ HDAC10 Q969S8 4/20 0.39
▸ HDAC11 Q96DB2 4/20 0.39
▸ HDAC8 Q9BY41 4/20 0.39
▸ HDAC6 Q9UBN7 4/20 0.39
▸ HDAC9 Q9UKV0 4/20 0.39
▸ HDAC5 Q9UQL6 4/20 0.39
▸ DPP4 P27487 1/20 0.39
▸ IDO1 P14902 1/20 0.35
▸ NPC1 O15118 1/20 0.35

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
SCHEMBL9530751 0.81 CYP19A1 (0.52) PKMMAPTNPC1RAB9A
SCHEMBL12620351 0.75 FLT3 (0.54) FLT3GSK3BTP53PKMLMNA
SCHEMBL11591093 0.73 FLT3 (0.77) FLT3GSK3BMMP2
SCHEMBL25983329 0.68 HDAC3 (0.51) FLT3GSK3BHDAC3HDAC4HDAC1
SCHEMBL1456921 0.66 LMNA (0.59) FLT3GSK3BTP53PKMLMNA
SCHEMBL16271178 0.66 FLT3 (0.66) FLT3GSK3B
SCHEMBL9141194 0.65 — —
SCHEMBL28795624 0.65 MAPT (0.92) TP53PKMLMNAMAPTHDAC1
SCHEMBL21111108 0.64 KMT2A (0.62) TP53LMNAMAPTNPC1RAB9A
SCHEMBL9728 0.61 MAPT (1.00) TP53PKMLMNAMAPTHDAC1

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
EP-0641797-A1 Cephem derivatives and antimicrobial agents containing the same KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1995-03-08 — — EP disclosed
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