SCHEMBL4802103

SCHEMBL4802103

CCCCCc1ncc(N)c(CCCCC)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 2/20 0.37
HSD17B10 Q99714 2/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
TLR7 Q9NYK1 4/20 0.36
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36
PI4K2A Q9BTU6 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL4551053 0.84 DHFR (0.45) DHFRMEN1KMT2AKDM4EGAA
SCHEMBL11002501 0.81 MAPT (0.36) MEN1KMT2AKDM4EGAAHSD17B10
Benzene SCHEMBL28801411 0.81 GPR84 (0.41) DHFRKDM4EUSP2TDP1TLR7
SCHEMBL4941629 0.80 TDP1 (0.37) DHFRMEN1KMT2AKDM4EGAA
SCHEMBL11001073 0.79 MAPT (0.39) MEN1KMT2AKDM4EGAAHSD17B10
SCHEMBL3642529 0.78 ADORA2A (0.39) MEN1KMT2AKDM4EGAAHSD17B10
SCHEMBL83448 0.75 KDM4E (0.54) MEN1KMT2AKDM4EGAAHSD17B10
SCHEMBL27884409 0.74 HRH3 (0.36) MEN1KMT2AKDM4EUSP2ALDH1A1
SCHEMBL11577082 0.74 GCGR (0.36) MEN1KMT2AKDM4EHSD17B10ALDH1A1
SCHEMBL17967585 0.73 RAB9A (0.57) MEN1KMT2AKDM4EGAAHSD17B10

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114805301-B 2, 4-diaryl aminopyrimidine compound and preparation method and application thereof 沈阳药科大学 2024-04-05 CN claimed
CN-116003331-A 2, 4-diarylaminopyrimidine derivative and application thereof 浙江工业大学 2023-04-25 CN claimed
CN-110218205-B 2, 4-diarylaminopyrimidine derivatives containing pyridine structure and application thereof 辽宁大学 2022-04-05 CN claimed
CN-111484484-B 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2021-11-23 CN claimed
CN-111484484-A 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2020-08-04 CN claimed
CN-114805301-B 2, 4-diaryl aminopyrimidine compound and preparation method and application thereof 沈阳药科大学 2024-04-05 CN disclosed
CN-114805301-B 2, 4-diaryl aminopyrimidine compound and preparation method and application thereof 沈阳药科大学 2024-04-05 CN disclosed
CN-114805301-B 2, 4-diaryl aminopyrimidine compound and preparation method and application thereof 沈阳药科大学 2024-04-05 CN disclosed
CN-116003331-A 2, 4-diarylaminopyrimidine derivative and application thereof 浙江工业大学 2023-04-25 CN disclosed
CN-116003331-A 2, 4-diarylaminopyrimidine derivative and application thereof 浙江工业大学 2023-04-25 CN disclosed
CN-114805301-A 2, 4-diarylaminopyrimidine compounds and preparation method and application thereof 沈阳药科大学 2022-07-29 CN disclosed
CN-114805301-A 2, 4-diarylaminopyrimidine compounds and preparation method and application thereof 沈阳药科大学 2022-07-29 CN disclosed
CN-111484484-B 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2021-11-23 CN disclosed
CN-111484484-B 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2021-11-23 CN disclosed
CN-111484484-B 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2021-11-23 CN disclosed
CN-111484484-A 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2020-08-04 CN disclosed
CN-111484484-A 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2020-08-04 CN disclosed
CN-111484484-A 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2020-08-04 CN disclosed
CN-108329232-A Hydrazide derivative and its application 浙江大学 2018-07-27 CN disclosed
WO-2008060866-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-05-22 WO disclosed