SCHEMBL28442012

SCHEMBL28442012

NC(=O)N1CCN(c2nc(Nc3ccc(N4CCOCC4)cc3)ncc2N)CC1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.57
▸ FLT3 P36888 2/20 0.57
▸ SYK P43405 10/20 0.56
▸ STAT6 P42226 5/20 0.53
▸ MAPK8 P45983 1/20 0.52
▸ MAPK9 P45984 1/20 0.52
▸ MAPK10 P53779 1/20 0.52
▸ CSF1R P07333 1/20 0.49

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
SCHEMBL28441100 0.89 JAK2 (0.61) JAK2FLT3SYKSTAT6MAPK8
SCHEMBL28897515 0.86 JAK3 (0.62) JAK2FLT3SYKSTAT6
SCHEMBL24426171 0.84 JAK2 (0.81) JAK2FLT3SYK
SCHEMBL28442021 0.83 POLB (0.45) STAT6MAPK8MAPK9MAPK10
SCHEMBL28437339 0.81 JAK2 (0.75) JAK2FLT3SYKMAPK8
SCHEMBL29669890 0.81 JAK2 (0.75) JAK2FLT3SYKMAPK8
SCHEMBL28442019 0.78 — —
SCHEMBL1020619 0.78 SYK (0.64) SYK
SCHEMBL28447910 0.75 JAK3 (0.65) JAK2SYKMAPK9MAPK10CSF1R
SCHEMBL28434553 0.75 MAPT (0.65) JAK2FLT3SYK

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
CN-111423384-B 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2021-10-15 — — CN claimed
CN-111423384-A 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2020-07-17 — — CN claimed
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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