SCHEMBL10386027

SCHEMBL10386027

CC(=O)CC(=O)Nc1ccc2c(c1)[nH]c(=O)n2C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 1/20 0.51
▸ KDM4E B2RXH2 4/20 0.47
▸ MAPT P10636 2/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ ERCC1 P07992 2/20 0.44
▸ FEN1 P39748 2/20 0.44
▸ ERCC4 Q92889 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ PSMB8 P28062 1/20 0.42
▸ DNASE1 P24855 1/20 0.41

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
SCHEMBL11548746 0.89 PSMB8 (0.54) NLRP3KDM4EMAPTALDH1A1MEN1
SCHEMBL31035885 0.85 NLRP3 (0.52) NLRP3KDM4EMAPTALDH1A1MEN1
SCHEMBL10386822 0.84 KDM4E (0.57) KDM4EMAPTALDH1A1MEN1CYP1A2
SCHEMBL10998887 0.83 CYP1A2 (0.52) NLRP3KDM4EMAPTALDH1A1CYP1A2
SCHEMBL11545418 0.77 SMN1; SMN2 (0.74) KDM4EMAPTALDH1A1MEN1CYP1A2
SCHEMBL11551548 0.76 KDM4E (0.54) KDM4EMAPTALDH1A1MEN1CYP1A2
SCHEMBL14566624 0.76 LMNA (0.53) NLRP3MAPTMEN1KMT2ALMNA
SCHEMBL1152724 0.76 MAPT (0.61) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL30237615 0.76 MAPT (0.61) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL9508666 0.76 MAPT (0.57) KDM4EMAPTALDH1A1MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4935502-A Diazo compounds, a process for their preparation and their use as colorants HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-19 — — US disclosed
US-4870164-A INTENSE YELLOW PIGMENTS HOECHST AKTIENGESELLSCHAFT (DE) 1989-09-26 — — US disclosed
EP-0024702-B1 DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1983-02-16 — — EP disclosed
EP-0024702-A2 Disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1981-03-11 — — EP disclosed
US-4169830-A POLYVINYL CHLORIDE, POLYESTERS, POLYAMIDES HOECHST AKTIENGESELLSCHAFT (DE) 1979-10-02 — — US disclosed
US-4169091-A Symmetrical and asymmetrical disazo compounds containing a bis-(nitro-aryloxy)alkane middle component HOECHST AKTIENGESELLSCHAFT (DE) 1979-09-25 — — US disclosed
US-3963694-A AZO PIGMENTS, POLYESTERS, CELLULOSE ETHERS AND ESTERS CIBA-GEIGY CORPORATION (US) 1976-06-15 — — US disclosed
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