SCHEMBL16371127

SCHEMBL16371127

C=CC(=O)Nc1ccccc1Oc1nc(Nc2ccc(N3CCN(CCF)CC3)c(F)c2)ncc1F

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 6/20 0.57
MAP2K1 Q02750 6/20 0.57
MAPK1 P28482 5/20 0.57
FLT3 P36888 2/20 0.56
EGFR P00533 8/20 0.52
JAK3 P52333 5/20 0.52
BTK Q06187 4/20 0.52
JAK2 O60674 1/20 0.52
JAK1 P23458 1/20 0.52
LRRK2 Q5S007 1/20 0.52
ITK Q08881 2/20 0.50

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
SCHEMBL16370532 0.94 MAP3K7 (0.66) MAP3K7MAP2K1MAPK1FLT3EGFR
SCHEMBL30672750 0.94 MAP3K7 (0.66) MAP3K7MAP2K1MAPK1FLT3EGFR
SCHEMBL16391080 0.88 EGFR (0.65) EGFRJAK3BTKJAK2JAK1
SCHEMBL16370819 0.86 SRC (0.53) MAP3K7MAP2K1MAPK1FLT3EGFR
SCHEMBL30672740 0.86 SRC (0.53) MAP3K7MAP2K1MAPK1FLT3EGFR
SCHEMBL16370374 0.84 EGFR (0.63) MAP3K7MAP2K1MAPK1FLT3EGFR
SCHEMBL16391116 0.82 EGFR (0.72) EGFRJAK3BTKITK
SCHEMBL16391089 0.81 JAK3 (0.60) EGFRJAK3BTKITK
SCHEMBL28561697 0.79 MAP3K7 (0.63) MAP3K7MAP2K1MAPK1FLT3EGFR
SCHEMBL16391084 0.79 EGFR (0.69) EGFRJAK3BTKJAK2JAK1

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 12 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
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-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
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
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 MAP3K7 204/4885MAP2K1 160/4885MAPK1 357/4885
US-20150133457-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF BMX, BLK, BTK MAP3K7 204/4885MAP2K1 160/4885MAPK1 357/4885
US-10562918-B2 Heterocyclic compounds and uses thereof BMX, BLK, BTK MAP3K7 204/4885MAP2K1 160/4885MAPK1 357/4885
US-20180251475-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF BMX, BLK, BTK MAP3K7 204/4885MAP2K1 160/4885MAPK1 357/4885

“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.