SCHEMBL5584058

SCHEMBL5584058

COc1ccnc(C(=O)Nc2cc(C(C)(C)C)cc(C(C)(C)C)c2)c1O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 13/20 0.50
MAPT P10636 3/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
PRKCI P41743 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.40
KDR P35968 1/20 0.40

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
SCHEMBL5583578 0.89 SMN1; SMN2 (0.53) NR1I2MAPTSMN1; SMN2TP53KDR
SCHEMBL5583713 0.88 KDR (0.46) NR1I2MAPTSMN1; SMN2TP53KDR
SCHEMBL5583560 0.86 PKM (0.42) NR1I2MAPTTSHRSMN1; SMN2TP53
SCHEMBL5583850 0.83 KDR (0.50) NR1I2MAPTSMN1; SMN2TP53KDR
SCHEMBL5583704 0.82 KDR (0.49) MAPTTSHRSMN1; SMN2KDM4EKDR
SCHEMBL5583719 0.80 NPC1 (0.53) MAPTSMN1; SMN2KDM4EALDH1A1KDR
SCHEMBL5583675 0.80 ALDH1A1 (0.48) NR1I2MAPTTSHRSMN1; SMN2KDM4E
SCHEMBL5583752 0.80 MAPT (0.57) MAPTKDR
SCHEMBL5583759 0.80 KDR (0.47) NR1I2MAPTSMN1; SMN2TP53KDR
SCHEMBL5583684 0.79 KDM4E (0.55) MAPTSMN1; SMN2KDM4EKDR

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