SCHEMBL22296379

SCHEMBL22296379

C=CC(=O)N1CCCC(N(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 8/20 0.51
JAK1 P23458 1/20 0.51
BTK Q06187 12/20 0.40
EGFR P00533 2/20 0.40

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
SCHEMBL22296385 1.00 JAK3 (0.51) JAK3JAK1BTKEGFR
SCHEMBL22296219 1.00 JAK3 (0.51) JAK3JAK1BTKEGFR
SCHEMBL22222678 0.95 JAK3 (0.47) JAK3JAK1BTKEGFR
SCHEMBL22296280 0.95 JAK3 (0.47) JAK3JAK1BTKEGFR
SCHEMBL15695604 0.90 BTK (0.46) JAK3JAK1BTK
SCHEMBL23865962 0.84 JAK3 (0.47) JAK3JAK1BTKEGFR
SCHEMBL22222613 0.84 JAK3 (0.47) JAK3JAK1BTKEGFR
SCHEMBL21706961 0.84 JAK3 (0.47) JAK3JAK1BTKEGFR
SCHEMBL22296380 0.84 JAK3 (0.47) JAK3JAK1BTKEGFR
SCHEMBL22222691 0.84 JAK3 (0.47) JAK3JAK1BTKEGFR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022133064-A1 FUSED PYRIMIDINE COMPOUNDS AS INHIBITORS OF MENIN-MLL INTERACTION BIOMEA FUSION, INC. (US) 2022-06-23 WO disclosed
EP-3689871-B1 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE SHANGHAI HAIYAN PHARMACEUTICAL TECH CO LTD (CN) 2021-09-29 EP disclosed
EP-3689871-A1 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2020-08-05 EP disclosed