SCHEMBL3248294

SCHEMBL3248294

CC(=O)Oc1ccccc1Oc1cc(N)c(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 3/20 0.39
PTGS2 P35354 3/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ESR1 P03372 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
HMGB1 P09429 1/20 0.39
GGT1 P19440 1/20 0.39
PTGS1 P23219 1/20 0.39
BLM P54132 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
SCN9A Q15858 3/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
RAB9A P51151 2/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL3248291 0.87 SCN9A (0.37) KDM4EALDH1A1HPGDSCN9ARAB9A
SCHEMBL17466053 0.85 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL7577594 0.81 ESRRA (0.44) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL3246041 0.79 PTGDR2 (0.50) KDM4EALDH1A1HPGDTSHRTDP1
SCHEMBL13841333 0.79 LMNA (0.50) KDM4EALDH1A1HPGDTSHRKMT2A
SCHEMBL6246195 0.79 SLC6A2 (0.40) KDM4EALDH1A1HPGDTSHRSCN9A
SCHEMBL1037978 0.76 CHRM1 (0.57) ALDH1A1HPGDKMT2AMAPTSMN1; SMN2
SCHEMBL10496464 0.75 PTGS2 (0.61) KDM4EALDH1A1PTGS2HPGDHSD17B10
SCHEMBL14639545 0.74 SLC6A2 (0.42) RAB9ANPC1MAPT
SCHEMBL3926982 0.73 SLC6A2 (0.39) KDM4EALDH1A1HPGDTSHRSCN9A

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-1736052-B1 Stem/leaf desiccant SUMITOMO CHEMICAL CO (JP) 2010-04-21 EP disclosed
EP-1736052-A2 Stem/leaf desiccant Sumitomo Chemical Company, Limited (JP) 2006-12-27 EP disclosed
EP-1397958-A1 STEAM/LEAF DESSICANT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-17 EP disclosed
WO-2002098227-A1 PLANT GROWTH REGULATORS FOR COTTON HERVEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-12 WO disclosed