SCHEMBL24405263

SCHEMBL24405263

CCOC(=O)CCN(CCC(=O)OCC)c1cc(NC(C)=O)c(/N=N/c2cc(F)c([N+](=O)[O-])cc2[N+](=O)[O-])cc1OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GALR2 O43603 1/20 0.39
MITF O75030 1/20 0.39
POLB P06746 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
CCR6 P51684 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 3/20 0.38
TNF P01375 1/20 0.35
USP2 O75604 1/20 0.35
AGTR1 P30556 1/20 0.34
MAPT P10636 5/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
PKM P14618 2/20 0.33

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
SCHEMBL24405276 0.97 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL24405249 0.93 ALDH1A1 (0.40) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL24405343 0.93 MAPT (0.35) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL22476557 0.92 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL22476622 0.91 ALDH1A1 (0.34) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL22474171 0.91 ALDH1A1 (0.34) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL22476552 0.91 HCAR3 (0.36) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL24405340 0.89 ALDH1A1 (0.36) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL22474142 0.89 ALDH1A1 (0.37) ALDH1A1LMNASMN1; SMN2GALR2MITF
SCHEMBL24405467 0.88 SMN1; SMN2 (0.36) ALDH1A1LMNASMN1; SMN2GALR2MITF

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-3715423-B1 HIGH WET FAST DISPERSE DYE MIXTURES OF N-[4-(5-FLUORO-2,4-DINITRO-PHENYLAZO)-PHENYL]-AMINE DERIVATIVES AND N-[4-(4-NITRO-PHENYLAZO)-PHENYL]-AMINE DERIVATIVES DYSTAR COLOURS DISTRIB GMBH (DE) 2022-05-11 EP disclosed