SCHEMBL19876216

SCHEMBL19876216

NCc1ccc(-c2ccnc3[nH]c(=O)[nH]c23)cc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 7/20 0.57
▸ BRD4 O60885 1/20 0.46
▸ BRAF P15056 7/20 0.37
▸ AAK1 Q2M2I8 1/20 0.37
▸ ENPP1 P22413 1/20 0.36
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ ALK Q9UM73 1/20 0.36

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
Hydrochloric Acid SCHEMBL19876241 0.99 BTK (0.56) BTKBRD4BRAFAAK1ENPP1
SCHEMBL19876272 0.84 BTK (0.56) BTKBRD4ENPP1
SCHEMBL19876171 0.78 BTK (0.47) BTKBRD4
SCHEMBL26953499 0.76 AAK1 (0.57) AAK1ALK
SCHEMBL31735126 0.76 AAK1 (0.57) AAK1ALK
SCHEMBL19876179 0.74 BTK (0.82) BTK
SCHEMBL19876207 0.74 BTK (0.60) BTK
SCHEMBL19876260 0.74 BTK (1.00) BTKBRD4AAK1
SCHEMBL19876220 0.72 BTK (0.57) BTK
SCHEMBL19876258 0.71 BRD4 (0.44) BTKBRD4BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3500569-B1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2022-05-18 — — EP disclosed
CN-109641892-B 2-oxo-imidazopyridines as reversible BTK inhibitors and uses thereof 默克专利有限公司 2021-07-02 — — CN disclosed
EP-3500569-A1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF Merck Patent GmbH (DE) 2019-06-26 — — EP disclosed
US-10266528-B2 2-oxo-imidazopyridines as reversible BTK inhibitors and uses thereof MERCK PATENT GMBH (DE) 2019-04-23 — — US disclosed
US-20180051024-A1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2018-02-22 — — US disclosed
WO-2018035080-A1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2018-02-22 — — 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 (2 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-10266528-B2 2-oxo-imidazopyridines as reversible BTK inhibitors and uses thereof BTK, SYK, LCK BTK 1/4885BRD4 85/4885BRAF 224/4885
US-20180051024-A1 2-OXO-IMIDAZOPYRIDINES AS REVERSIBLE BTK INHIBITORS AND USES THEREOF BTK, SYK, LCK BTK 1/4885BRD4 85/4885BRAF 224/4885

“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.

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