SCHEMBL2528699

SCHEMBL2528699

CCCCCCCC(=O)Oc1ccc(C(=O)c2ccccc2)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.58
MAPK1 P28482 2/20 0.58
HTT P42858 2/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
CYP1A2 P05177 1/20 0.58
PGR P06401 1/20 0.58
CYP2D6 P10635 1/20 0.58
SLC6A2 P23975 1/20 0.58
PDE4A P27815 1/20 0.58
CYP2C19 P33261 1/20 0.58
HRH1 P35367 1/20 0.58
SLC6A3 Q01959 1/20 0.58
PDE4D Q08499 1/20 0.58
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.50
USP2 O75604 1/20 0.50
GAA P10253 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50

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
SCHEMBL6544988 1.00 HPGD (0.58) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL20597705 1.00 HPGD (0.58) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL5995842 1.00 HPGD (0.58) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL6660092 1.00 HPGD (0.58) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL5384188 0.90 HPGD (0.57) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL11442389 0.90 HPGD (0.52) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL12919756 0.90 HTT (0.52) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL6657868 0.89 HPGD (0.57) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL5384697 0.89 HPGD (0.58) HPGDMAPK1HTTALDH1A1LMNA
SCHEMBL5387541 0.88 HPGD (0.54) HPGDMAPK1HTTALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039549-B2 Method for producing aqueous polymer dispersions containing at least one lipophilic active substance and the use thereof BASF AKTIENGESELLSCHAFT (DE) 2011-10-18 US disclosed
US-20090178773-A1 METHOD FOR PRODUCING AQUEOUS POLYMER DISPERSIONS CONTAINING AT LEAST ONE LIPOPHILIC ACTIVE SUBSTANCE AND THE USE THEREOF BASF SE (DE) 2009-07-16 US disclosed
EP-0834254-B1 Azadirachtin formulations and a process for preparing them from neem seed/kernel COUNCIL SCIENT IND RES (IN) 2003-03-05 EP disclosed
US-5856526-A Pesticidal dry powder formulation enriched in azadirachtin up to 88% an emulsifiable concentrate enriched up to 30% of azadirachtin and a process for preparing such formulation and concentrate from neem seed/kernel COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1999-01-05 US disclosed
EP-0834254-A1 Azadirachtin formulations and a process for preparing them from neem seed/kernel Council of Scientific and Industrial Research (IN) 1998-04-08 EP disclosed