SCHEMBL4765446

SCHEMBL4765446

Cn1c(=O)c(-c2ccccc2)cc2c3cc(C(=O)NNC(=O)O)ccc3n(C)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ NLRP3 Q96P20 1/20 0.42
▸ MAPT P10636 4/20 0.41
▸ CTDSP1 Q9GZU7 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ EGLN1 Q9GZT9 1/20 0.40
▸ HDAC6 Q9UBN7 2/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ SCN9A Q15858 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ NPC1 O15118 2/20 0.38

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
SCHEMBL3571739 0.88 KDM4E (0.43) KDM4EMAPTEGLN1HDAC6HDAC1
SCHEMBL3569292 0.86 KDM4E (0.58) KDM4EKMT2APOLBEGLN1ALDH1A1
SCHEMBL3567581 0.82 KMT2A (0.40) KDM4EMEN1KMT2ANLRP3MAPT
SCHEMBL3867984 0.80 HSD17B10 (0.46) KDM4EMEN1KMT2AMAPTPOLB
SCHEMBL3567710 0.79 KDM4E (0.42) KDM4EMEN1KMT2ANLRP3MAPT
SCHEMBL3866299 0.76 HSD17B10 (0.44) KDM4EMEN1KMT2AMAPTPOLB
SCHEMBL4762397 0.74 KDM4E (0.46) KDM4EMAPTALDH1A1HPGD
SCHEMBL1339005 0.74 ALDH1A1 (0.42) KDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL1338146 0.74 MEN1 (0.39) KDM4EMEN1KMT2AMAPTPOLB
SCHEMBL1339208 0.74 KDM4E (0.42) KDM4EMEN1KMT2AMAPTALDH1A1

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
EP-1742947-B1 6-SUBSTITUTED PYRIDOINDOLONE DERIVATIVES PRODUCTION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2008-08-20 — — EP disclosed
EP-1742947-A1 6-SUBSTITUTED PYRIDOINDOLONE DERIVATIVES PRODUCTION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-01-17 — — EP disclosed
WO-2005108398-A1 6-SUBSTITUTED PYRIDOINDOLONE DERIVATIVES PRODUCTION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2005-11-17 — — WO disclosed
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