SCHEMBL5584053

SCHEMBL5584053

CCC(C)c1cccc(C(C)CC)c1Oc1ccc(NC(=O)c2ncccc2O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
GRM4 Q14833 4/20 0.45
RAB9A P51151 7/20 0.44
NPC1 O15118 6/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
TP53 P04637 3/20 0.44
PKM P14618 2/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
MITF O75030 1/20 0.44
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42

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
SCHEMBL5583780 0.77 PNLIP (0.63) RAB9ANPC1SMN1; SMN2TP53LMNA
SCHEMBL5583813 0.74 CSF1R (0.55) GRM4RAB9ANPC1SMN1; SMN2PKM
SCHEMBL14284358 0.72 TLR7 (0.62) RAB9ANPC1MAPT
SCHEMBL13788784 0.71 TSHR (0.40) ALDH1A1GAALMNAHTTMAPT
SCHEMBL18027788 0.71 KDM4E (0.73) KDM4EALDH1A1GRM4RAB9ANPC1
SCHEMBL12355529 0.70 TSHR (0.39) ALDH1A1GAALMNAHTTMAPT
SCHEMBL5583621 0.70 TLR7 (0.57) GAARET
SCHEMBL13201028 0.70 ATR (0.61) KDM4EALDH1A1GAAGRM4TP53
SCHEMBL12347495 0.69 TSHR (0.38) ALDH1A1GAALMNAHTTMAPT
SCHEMBL14284354 0.69 TLR7 (0.67) KDM4EALDH1A1GRM4RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183278-B1 Picolinamide derivative and harmful organism control agent comprising said picolinamide derivative as active component MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-27 US disclosed
EP-1134214-A1 PICOLINAMIDE DERIVATIVES AND PEST CONTROLLERS CONTAINING THE SAME AS THE ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2001-09-19 EP disclosed