SCHEMBL8355871

SCHEMBL8355871

CCCCOC(=O)c1ccc(NC(=O)C=CC(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.67
RECQL P46063 1/20 0.67
MAPT P10636 7/20 0.65
KMT2A Q03164 6/20 0.65
MEN1 O00255 5/20 0.65
KDM4E B2RXH2 3/20 0.65
THRA P10827 1/20 0.59
THRB P10828 1/20 0.59
RAB9A P51151 3/20 0.58
NPC1 O15118 1/20 0.58
CASP1 P29466 1/20 0.58
SMN1; SMN2 Q16637 5/20 0.57
ALDH1A1 P00352 3/20 0.57
LMNA P02545 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
HTT P42858 2/20 0.55
GAA P10253 1/20 0.55
MAPK1 P28482 3/20 0.55
POLB P06746 3/20 0.55
CYP1A2 P05177 2/20 0.55

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
SCHEMBL8355864 1.00 HPGD (0.67) HPGDRECQLMAPTKMT2AMEN1
SCHEMBL7825125 0.86 KMT2A (0.64) MAPTKMT2AMEN1KDM4ETHRB
SCHEMBL7825122 0.86 KMT2A (0.64) MAPTKMT2AMEN1KDM4ETHRB
SCHEMBL30764099 0.83 ALDH1A1 (0.65) MAPTKMT2ATHRATHRBSMN1; SMN2
SCHEMBL10943133 0.80 RAB9A (0.86) HPGDRECQLMAPTKMT2AMEN1
SCHEMBL10943491 0.80 HPGD (0.78) HPGDRECQLMAPTKMT2AMEN1
SCHEMBL8352812 0.80 NMT1 (0.65) MAPTKMT2AMEN1KDM4ETHRB
SCHEMBL8352817 0.80 NMT1 (0.65) MAPTKMT2AMEN1KDM4ETHRB
Hydrogen Peroxide SCHEMBL28645617 0.80 ESR1 (0.82) HPGDRECQLMAPTRAB9ANPC1
SCHEMBL27667907 0.80 ESR1 (0.82) HPGDRECQLMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758314-B1 COMPOUNDS CONTAINING A MICHAEL-ACCEPTOR, ESPECIALLY MALEIMIDE OR MALEIC ACID DERIVATIVES, DIRECTLY OR INDIRECTLY LINKED TO A CHROMOPHORE AND THEIR USE IN LONG LASTING SUNSCREEN COMPOSITIONS VANGUARD MEDICA LTD (GB) 1999-09-15 EP claimed
US-5877204-A Compounds containing a michael-acceptor, especially maleimide or maleic acid derivatives, directly or indirectly linked to a chromophore and their use in long lasting sunscreen compositions VANGUARD MEDICA LIMITED (GB) 1999-03-02 US claimed
EP-0758314-A1 COMPOUNDS CONTAINING A MICHAEL-ACCEPTOR, ESPECIALLY MALEIMIDE OR MALEIC ACID DERIVATIVES, DIRECTLY OR INDIRECTLY LINKED TO A CHROMOPHORE AND THEIR USE IN LONG LASTING SUNSCREEN COMPOSITIONS Vanguard Medica Limited (GB) 1997-02-19 EP claimed
WO-1995030646-A1 COMPOUNDS CONTAINING A MICHAEL-ACCEPTOR, ESPECIALLY MALEIMIDE OR MALEIC ACID DERIVATIVES, DIRECTLY OR INDIRECTLY LINKED TO A CHROMOPHORE AND THEIR USE IN LONG LASTING SUNSCREEN COMPOSITIONS VANGUARD MEDICA LIMITED (GB) 1995-11-16 WO claimed
EP-0758314-B1 COMPOUNDS CONTAINING A MICHAEL-ACCEPTOR, ESPECIALLY MALEIMIDE OR MALEIC ACID DERIVATIVES, DIRECTLY OR INDIRECTLY LINKED TO A CHROMOPHORE AND THEIR USE IN LONG LASTING SUNSCREEN COMPOSITIONS VANGUARD MEDICA LTD (GB) 1999-09-15 EP disclosed
US-5877204-A Compounds containing a michael-acceptor, especially maleimide or maleic acid derivatives, directly or indirectly linked to a chromophore and their use in long lasting sunscreen compositions VANGUARD MEDICA LIMITED (GB) 1999-03-02 US disclosed
EP-0758314-A1 COMPOUNDS CONTAINING A MICHAEL-ACCEPTOR, ESPECIALLY MALEIMIDE OR MALEIC ACID DERIVATIVES, DIRECTLY OR INDIRECTLY LINKED TO A CHROMOPHORE AND THEIR USE IN LONG LASTING SUNSCREEN COMPOSITIONS Vanguard Medica Limited (GB) 1997-02-19 EP disclosed
WO-1995030646-A1 COMPOUNDS CONTAINING A MICHAEL-ACCEPTOR, ESPECIALLY MALEIMIDE OR MALEIC ACID DERIVATIVES, DIRECTLY OR INDIRECTLY LINKED TO A CHROMOPHORE AND THEIR USE IN LONG LASTING SUNSCREEN COMPOSITIONS VANGUARD MEDICA LIMITED (GB) 1995-11-16 WO disclosed