SCHEMBL28265669

SCHEMBL28265669

NC(=O)c1n[nH]c(=O)cc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.38
KCNMA1 Q12791 2/20 0.35
KDR P35968 2/20 0.34
AR P10275 4/20 0.34
MAP2K4 P45985 1/20 0.34
CTNNB1 P35222 1/20 0.33
WNT3A P56704 1/20 0.33
MAP4K4 O95819 1/20 0.33
PIM1 P11309 1/20 0.33
GPX4 P36969 1/20 0.33
GSK3B P49841 1/20 0.33
PIM3 Q86V86 1/20 0.33
BRSK1 Q8TDC3 1/20 0.33
MAP4K5 Q9Y4K4 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL20606593 0.84 HCAR2 (0.38) KDRCTNNB1WNT3AMAP4K4PIM1
SCHEMBL20606539 0.75 POLB (0.48) ARALDH1A1HPGDKMT2AKDM4E
SCHEMBL15635227 0.73 KCNMA1 (0.34) KCNMA1MAP2K4CTNNB1WNT3AKMT2A
SCHEMBL30398942 0.73 SYK (0.40) SYKKCNMA1KDRMEN1KMT2A
SCHEMBL20936728 0.71 AR (0.42) ARALDH1A1LMNAKDM4E
SCHEMBL31088779 0.71 NOTUM (0.40) KDRARMAP4K4PIM1GPX4
SCHEMBL30202675 0.70 JAK2 (0.43) SYKKCNMA1KDRKMT2AKDM4E
SCHEMBL31465029 0.69 KMT2A (0.38) ARMAP2K4LMNAKMT2ASCN9A
SCHEMBL16252832 0.68 CTNNB1 (0.44) KCNMA1ARCTNNB1WNT3AMEN1
SCHEMBL30448224 0.68 SYK (0.43) SYKPIM1PIM3IDO1AKR1B1

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
CN-116283920-B 2, 4-disubstituted pyridine compound and application thereof 贵州医科大学 2024-04-16 CN claimed
CN-116283920-A 2, 4-disubstituted pyridine compound and application thereof 贵州医科大学 2023-06-23 CN claimed
CN-109195965-A The inhibitor that WDR5 protein-protein combines 普罗佩纶治疗公司 2019-01-11 CN claimed
CN-116283920-B 2, 4-disubstituted pyridine compound and application thereof 贵州医科大学 2024-04-16 CN disclosed
CN-116283920-A 2, 4-disubstituted pyridine compound and application thereof 贵州医科大学 2023-06-23 CN disclosed