SCHEMBL16370751

SCHEMBL16370751

C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(CCS(C)(=O)=O)CC4)cc3)ncc2OC)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.65
JAK3 P52333 5/20 0.65
JAK2 O60674 3/20 0.65
BLK P51451 2/20 0.65
BMX P51813 2/20 0.65
MAP3K7 O43318 1/20 0.63
MAPK1 P28482 1/20 0.63
MAP2K1 Q02750 1/20 0.63
BTK Q06187 5/20 0.60
NUAK1 O60285 2/20 0.60
PLK4 O00444 1/20 0.60
GAK O14976 1/20 0.60
FLT3 P36888 1/20 0.60
CTSC P53634 1/20 0.60
PTK2 Q05397 1/20 0.60
ITK Q08881 1/20 0.60
ERBB4 Q15303 1/20 0.60
DCLK3 Q9C098 1/20 0.60
NUAK2 Q9H093 1/20 0.60
EML4 Q9HC35 1/20 0.60

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
SCHEMBL16706318 0.92 EGFR (0.69) EGFRJAK3JAK2BLKBMX
SCHEMBL16371031 0.91 EGFR (0.68) EGFRJAK3JAK2BLKBMX
SCHEMBL16370674 0.91 EGFR (0.68) EGFRJAK3JAK2BLKBMX
SCHEMBL30672842 0.91 EGFR (0.68) EGFRJAK3JAK2BLKBMX
SCHEMBL30672758 0.89 EGFR (0.81) EGFRJAK3JAK2BLKBMX
SCHEMBL16372156 0.89 EGFR (0.81) EGFRJAK3JAK2BLKBMX
SCHEMBL21338197 0.88 EGFR (0.65) EGFRJAK3JAK2BLKBMX
SCHEMBL16371039 0.85 NUAK1 (0.65) EGFRJAK3JAK2BLKBMX
SCHEMBL16370711 0.85 EGFR (0.62) EGFRJAK3BTKITK
SCHEMBL30672900 0.85 EGFR (0.62) EGFRJAK3BTKITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117486865-A Pyrimidine derivatives as kinase inhibitors 艾森医药公司 2024-02-02 CN disclosed
CN-112592334-B Pyrimidine derivatives as kinase inhibitors 艾森医药公司 2023-10-27 CN disclosed
CN-112592334-A Pyrimidine derivatives as kinase inhibitors 艾森生物科学公司 2021-04-02 CN disclosed
US-10562918-B2 Heterocyclic compounds and uses thereof ACEA Therapeutics, Inc. (US) 2020-02-18 US disclosed
US-10562918-B2 Heterocyclic compounds and uses thereof ACEA Therapeutics, Inc. (US) 2020-02-18 US disclosed
EP-3019496-B1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS ACEA THERAPEUTICS INC (US) 2019-09-11 EP disclosed
US-20180251475-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA BIOSCIENCES INC. 2018-09-06 US disclosed
US-9920074-B2 Heterocyclic compounds and uses thereof ACEA BIOSCIENCES INC. (US) 2018-03-20 US disclosed
US-9920074-B2 Heterocyclic compounds and uses thereof ACEA BIOSCIENCES INC. (US) 2018-03-20 US disclosed
US-9920074-B2 Heterocyclic compounds and uses thereof ACEA BIOSCIENCES INC. (US) 2018-03-20 US disclosed
US-20170029442-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA Therapeutics, Inc. 2017-02-02 US disclosed
US-20170029442-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA Therapeutics, Inc. 2017-02-02 US disclosed
US-20170029442-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA Therapeutics, Inc. 2017-02-02 US disclosed
US-9464089-B2 Heterocyclic compounds and uses thereof ACEA BIOSCIENCES INC. (US) 2016-10-11 US disclosed
US-9464089-B2 Heterocyclic compounds and uses thereof ACEA BIOSCIENCES INC. (US) 2016-10-11 US disclosed
EP-3019496-A2 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA Biosciences, Inc. (US) 2016-05-18 EP disclosed
US-20150133457-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA BIOSCIENCES INC. 2015-05-14 US disclosed
US-20150133457-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA BIOSCIENCES INC. 2015-05-14 US disclosed
WO-2015006754-A2 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA BIOSCIENCES INC. (US) 2015-01-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170029442-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF BMX, BLK, BTK EGFR 16/4885JAK3 30/4885JAK2 15/4885
US-20150133457-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF BMX, BLK, BTK EGFR 16/4885JAK3 30/4885JAK2 15/4885
US-10562918-B2 Heterocyclic compounds and uses thereof BMX, BLK, BTK EGFR 16/4885JAK3 30/4885JAK2 15/4885
US-20180251475-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF BMX, BLK, BTK EGFR 16/4885JAK3 30/4885JAK2 15/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.