SCHEMBL27447779

SCHEMBL27447779

CC1=NN(c2ccccn2)C(C=O)C1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 4/20 0.46
▸ PDCD1 Q15116 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ KDM4E B2RXH2 7/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ GRIN2B Q13224 1/20 0.36
▸ CCNA2 P20248 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ TERT O14746 1/20 0.35
▸ HPGD P15428 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
SCHEMBL22796294 0.78 CD274 (0.46) CD274PDCD1SMN1; SMN2KDM4EALDH1A1
SCHEMBL25178380 0.78 MAPT (0.48) SMN1; SMN2KDM4EALDH1A1MAPTMEN1
SCHEMBL22796296 0.78 CD274 (0.43) CD274PDCD1SMN1; SMN2KDM4EALDH1A1
SCHEMBL28091311 0.77 HTR3E (0.40) SMN1; SMN2KDM4EALDH1A1MAPTMEN1
SCHEMBL22796281 0.75 ESD (0.53) CD274PDCD1SMN1; SMN2KDM4EALDH1A1
SCHEMBL27732171 0.73 TERT (0.40) SMN1; SMN2KDM4EALDH1A1MAPTMEN1
SCHEMBL22795865 0.70 ESD (0.55) CD274PDCD1SMN1; SMN2KDM4EALDH1A1
SCHEMBL28158503 0.70 TERT (0.35) SMN1; SMN2ALDH1A1MAPTKMT2ANPSR1
SCHEMBL27712033 0.70 MAPT (0.38) SMN1; SMN2KDM4EALDH1A1MAPTMEN1
SCHEMBL27369841 0.70 ALDH1A1 (0.43) SMN1; SMN2KDM4EALDH1A1MAPTMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101001921-A Cationic pyrazolone dyes method for production thereof and colouring agents for keratin fibres containing said compounds WELLA AG (DE) 2007-07-18 — — CN disclosed
CN-1066138-C 4-(arylaminomethylene)-2,4-dihydro-3-pyrazolones MERCK PATENT GMBH (DE) 2001-05-23 — — CN disclosed
CN-1141291-A 4-(Arylaminomethylene)-2,4-dihydro-3-pyrazolones MERCK PATENT GMBH (DE) 1997-01-29 — — CN disclosed
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