SCHEMBL19877212

SCHEMBL19877212

COC(=O)c1ccc(F)c(-c2nc3cc(C(F)(F)F)nnc3n2C)n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.37
▸ ALDH1A1 P00352 6/20 0.35
▸ KDM4E B2RXH2 5/20 0.35
▸ HPGD P15428 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ CASP1 P29466 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ KCNN4 O15554 1/20 0.33
▸ CYP11B2 P19099 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ RBP4 P02753 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ SLC6A15 Q9H2J7 1/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ CASP7 P55210 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL29774758 0.92 MAPT (0.32) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL21796215 0.92 MAPT (0.32) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL18498690 0.89 NOTUM (0.40) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL31141489 0.89 NOTUM (0.40) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL18498705 0.84 POLB (0.33) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL18506249 0.84 DDR1 (0.35) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL19876693 0.82 MAPT (0.37) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL19876691 0.79 PDE2A (0.33) PDE2AHTT
SCHEMBL29720545 0.79 PDE2A (0.33) PDE2AHTT
SCHEMBL19876978 0.79 CYP11B1 (0.39) CYP11B2PDE2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10875858-B2 Process for preparing halogenated pyridine derivatives BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-12-29 — — US disclosed
US-10875858-B2 Process for preparing halogenated pyridine derivatives BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-12-29 — — US disclosed
EP-3500568-B1 PROCESS FOR THE PREPARATION OF 2-(3,6-DIHALOPYRIDIN-2-YL)-3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS BY REACTING THE 3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVE WITH A METAL-ORGANIC ZINC-AMINE BASE BAYER CROPSCIENCE AG (DE) 2020-09-23 — — EP disclosed
US-20190202829-A1 PROCESS FOR PREPARING HALOGENATED PYRIDINE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-07-04 — — US disclosed
US-20190202829-A1 PROCESS FOR PREPARING HALOGENATED PYRIDINE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-07-04 — — US disclosed
EP-3500568-A1 METHOD FOR PRODUCING 2-(3,6-DIHALOPYRIDIN-2-YL)-3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS BY REACTION OF THE 3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVE WITH AN ORGANOMETALLIC ZINC-AMINE BASE Bayer CropScience Aktiengesellschaft (DE) 2019-06-26 — — EP disclosed
WO-2018033448-A1 METHOD FOR PRODUCING 2-(3,6-DIHALOPYRIDIN-2-YL)-3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS BY REACTION OF THE 3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVE WITH AN ORGANOMETALLIC ZINC-AMINE BASE BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-02-22 — — WO disclosed
WO-2018033448-A1 METHOD FOR PRODUCING 2-(3,6-DIHALOPYRIDIN-2-YL)-3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS BY REACTION OF THE 3H-IMIDAZOL[4,5-C]PYRIDINE DERIVATIVE WITH AN ORGANOMETALLIC ZINC-AMINE BASE BAYER CROPSCIENCE AKTIENGESELLSCHAFT (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-10875858-B2 Process for preparing halogenated pyridine derivatives CBR3, NQO2, CBR1 MAPT 4568/4885ALDH1A1 3359/4885KDM4E 754/4885
US-20190202829-A1 PROCESS FOR PREPARING HALOGENATED PYRIDINE DERIVATIVES CBR3, NQO2, CBR1 MAPT 4568/4885ALDH1A1 3359/4885KDM4E 754/4885

“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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