SCHEMBL8658563

SCHEMBL8658563

COC(=O)c1ccc(C(=O)N2CCN(C(=O)c3ccc(C(=O)OC)cc3)CC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.68
GPR183 P32249 1/20 0.61
ALDH1A1 P00352 4/20 0.56
ALOX15 P16050 1/20 0.56
MGLL Q99685 1/20 0.56
HSD17B10 Q99714 1/20 0.56
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
CA12 O43570 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
LMNA P02545 1/20 0.54
KMT2A Q03164 1/20 0.53
PKM P14618 1/20 0.53
POLB P06746 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL17559346 0.93 HPGD (0.61) HPGDGPR183ALDH1A1ALOX15MGLL
SCHEMBL17559469 0.93 HPGD (0.61) HPGDGPR183ALDH1A1ALOX15MGLL
SCHEMBL64495 0.93 HPGD (0.78) HPGDGPR183ALDH1A1ALOX15LMNA
SCHEMBL17559372 0.93 HPGD (0.61) HPGDGPR183ALDH1A1ALOX15MGLL
SCHEMBL70433 0.92 HPGD (0.69) HPGDGPR183ALDH1A1KMT2ANPC1
SCHEMBL4620335 0.92 HPGD (0.73) HPGDGPR183ALDH1A1ALOX15MGLL
SCHEMBL23675251 0.91 HPGD (0.71) HPGDALDH1A1KMT2ANPC1RAB9A
SCHEMBL23280363 0.90 HPGD (0.58) HPGDGPR183ALDH1A1ALOX15MGLL
SCHEMBL25110067 0.88 HPGD (0.57) HPGDGPR183ALDH1A1ALOX15MGLL
SCHEMBL16845194 0.88 HPGD (0.56) HPGDGPR183ALDH1A1ALOX15MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0724568-B1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER PLC (GB) 1998-11-04 EP disclosed
EP-0724568-A1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER PLC (GB) 1996-08-07 EP disclosed
EP-0564251-B1 Amido peroxycarboxylic acids UNILEVER PLC (GB) 1995-09-06 EP disclosed
US-5397501-A Composition with surfactants for bleaching fabrics LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1995-03-14 US disclosed
WO-1995003275-A1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER N.V. (NL) 1995-02-02 WO disclosed
US-5268003-A Or salt thereof LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1993-12-07 US disclosed
EP-0564251-A2 Amido peroxycarboxylic acids UNILEVER PLC (GB) 1993-10-06 EP disclosed
EP-0564250-A2 Structured liquid detergent compositions containing amido and imido peroxy acids UNILEVER PLC (GB) 1993-10-06 EP disclosed
US-4663641-A LEUCO DYES; DECOLORIZING AGENTS, PIPERAZINE COMPOUND; AMIDES AND TERTIARY AMINES RICOH COMPANY, LTD. (JP) 1987-05-05 US disclosed