SCHEMBL28439364

SCHEMBL28439364

O=C(Nc1ccccc1)N1CCN(c2ccnc(Nc3ccc(C4CNCCO4)cc3)n2)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.54
▸ FLT3 P36888 5/20 0.54
▸ SLC6A3 Q01959 1/20 0.48
▸ KCNH2 Q12809 1/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48

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
SCHEMBL28896995 0.93 JAK2 (0.57) JAK2FLT3SLC6A3TAAR1
SCHEMBL28434573 0.91 JAK2 (0.67) JAK2FLT3
SCHEMBL28442728 0.91 JAK2 (0.67) JAK2FLT3SLC6A3TAAR1
SCHEMBL28447921 0.90 JAK2 (0.53) JAK2FLT3
SCHEMBL28451446 0.90 JAK2 (0.53) JAK2FLT3
SCHEMBL28440889 0.90 JAK2 (0.68) JAK2FLT3
SCHEMBL28439354 0.90 JAK2 (0.57) JAK2FLT3
SCHEMBL28442025 0.90 JAK2 (0.51) JAK2FLT3
SCHEMBL28451389 0.90 JAK2 (0.57) JAK2FLT3SLC6A3TAAR1
SCHEMBL28443300 0.90 JAK2 (0.57) JAK2FLT3SLC6A3TAAR1

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
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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