SCHEMBL9705735

SCHEMBL9705735

CC(O)CNC(=O)c1cc(Cl)c(O)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.54
NPC1 O15118 2/20 0.48
KDM4E B2RXH2 2/20 0.47
ACSS2 Q9NR19 1/20 0.45
TTR P02766 1/20 0.44
GAA P10253 3/20 0.44
KMT2A Q03164 3/20 0.44
HSD17B10 Q99714 1/20 0.44
SMPD1 P17405 1/20 0.40
HSD17B13 Q7Z5P4 1/20 0.40
RAB9A P51151 1/20 0.40
ACR P10323 1/20 0.40
ESR1 P03372 1/20 0.40
NAMPT P43490 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL878978 0.78 KDM4E (0.63) HPGDKDM4EACSS2GAAKMT2A
SCHEMBL13018868 0.76 POLB (0.53) HPGDNPC1KDM4ETTRGAA
SCHEMBL19836092 0.76 MEN1 (0.58) HPGDNPC1KDM4EKMT2ARAB9A
SCHEMBL19835585 0.76 MEN1 (0.58) HPGDNPC1KDM4EKMT2ARAB9A
SCHEMBL15087817 0.76 MEN1 (0.58) HPGDNPC1KDM4EKMT2ARAB9A
SCHEMBL9705706 0.74 HPGD (0.67) HPGDNPC1KDM4ETTRGAA
SCHEMBL9668334 0.74 MPO (0.52) HPGDNPC1ACSS2GAAKMT2A
SCHEMBL9717443 0.74 GAA (0.77) HPGDNPC1KDM4EACSS2GAA
SCHEMBL9705789 0.73 TAS1R3 (0.45) HPGDNPC1TTRGAAKMT2A
SCHEMBL30732620 0.73 ABCB1 (0.46) HPGDNPC1KDM4ETTRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0207454-B1 ISOXAZOLE AND FURAN DERIVATIVES, THEIR PREPARATION AND USE AS ANTIVIRAL AGENTS STERLING WINTHROP INC. (US) 1992-09-09 EP disclosed
US-5002960-A Viricides for combating picornaviruses STERLING DRUG, INC. (US) 1991-03-26 US disclosed
US-4939267-A Viricides STERLING DRUG INC. (US) 1990-07-03 US disclosed
US-4843087-A OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES STERLING DRUG INC. (US) 1989-06-27 US disclosed