SCHEMBL24426201

SCHEMBL24426201

CC(=O)c1ccc(NC(=O)N2CCN(c3nc(Nc4ccc(N5CCOCC5)c(F)c4)ncc3C)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 8/20 0.64
▸ FLT3 P36888 5/20 0.64
▸ JAK3 P52333 4/20 0.59
▸ JAK1 P23458 3/20 0.59
▸ TYK2 P29597 1/20 0.59
▸ MTOR P42345 3/20 0.50
▸ BRD4 O60885 2/20 0.48
▸ MAPK9 P45984 1/20 0.46
▸ MAPK10 P53779 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ SYK P43405 1/20 0.46
▸ BTK Q06187 1/20 0.46
▸ AXL P30530 1/20 0.46
▸ PIK3R1 P27986 1/20 0.46
▸ PIK3CA P42336 1/20 0.46

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
SCHEMBL28437346 0.90 JAK2 (0.64) JAK2FLT3JAK3JAK1TYK2
SCHEMBL24426203 0.89 JAK2 (0.63) JAK2FLT3JAK3JAK1TYK2
SCHEMBL22860801 0.88 JAK2 (0.82) JAK2FLT3JAK3JAK1TYK2
SCHEMBL28447910 0.86 JAK3 (0.65) JAK2JAK3JAK1TYK2MTOR
SCHEMBL28443652 0.85 JAK2 (0.64) JAK2FLT3JAK3MTORPTGS2
SCHEMBL28439360 0.84 JAK2 (0.63) JAK2FLT3JAK3JAK1TYK2
SCHEMBL28439357 0.81 JAK2 (0.51) JAK2FLT3
SCHEMBL28437348 0.80 JAK2 (0.64) JAK2FLT3JAK3JAK1TYK2
SCHEMBL29236036 0.80 JAK2 (0.70) JAK2FLT3JAK3JAK1TYK2
SCHEMBL28441098 0.79 JAK2 (0.61) JAK2FLT3MTORALDH1A1POLB

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-3998254-A1 2-AMINOPYRIMIDINE COMPOUND AND APPLICATION THEREOF Shenyang Pharmaceutical University (CN) 2022-05-18 — — EP disclosed
CN-113891881-A 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2022-01-04 — — CN disclosed
CN-111423384-B 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2021-10-15 — — CN disclosed
CN-111423384-A 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2020-07-17 — — CN disclosed
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