SCHEMBL20075426

SCHEMBL20075426

O=C1c2ccccc2C(=O)N1c1c(Cl)c(-c2ccc(F)cc2)nn1CC1CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC34A1 Q06495 7/20 0.42
PTGIR P43119 2/20 0.42
PTGS2 P35354 1/20 0.40
KCNH2 Q12809 1/20 0.39
GRM2 Q14416 1/20 0.39
AR P10275 1/20 0.38
MERTK Q12866 4/20 0.38
HTR1A P08908 1/20 0.37
HTR2A P28223 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
AXL P30530 1/20 0.36
TYRO3 Q06418 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
SCHEMBL21711372 0.89 KCNH2 (0.44) SLC34A1PTGS2KCNH2GRM2
SCHEMBL20075141 0.83 SLC34A1 (0.42) SLC34A1ARALDH1A1GAAKMT2A
SCHEMBL30298567 0.83 SLC34A1 (0.42) SLC34A1ARALDH1A1GAAKMT2A
SCHEMBL20074680 0.81 SLC34A1 (0.46) SLC34A1PTGIRPTGS2KCNH2GRM2
SCHEMBL20074928 0.80 SLC34A1 (0.42) SLC34A1PTGIRPTGS2KCNH2GRM2
SCHEMBL21711375 0.77 AR (0.43) SLC34A1ARALDH1A1KMT2A
SCHEMBL20075442 0.74 SLC34A1 (0.48) SLC34A1PTGS2MERTKAXLTYRO3
SCHEMBL21711478 0.74 GRIN2B (0.38) PTGIRARALDH1A1KMT2A
SCHEMBL21711317 0.73 KCNH2 (0.44) SLC34A1PTGS2KCNH2GRM2AR
SCHEMBL21711469 0.72 SLC34A1 (0.45) SLC34A1PTGS2KCNH2GRM2AR

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-20230065629-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-03-02 US disclosed
US-11208400-B2 Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof BAYER AKTIENGESELLSCHAFT (DE) 2021-12-28 US disclosed
US-11208400-B2 Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof BAYER AKTIENGESELLSCHAFT (DE) 2021-12-28 US disclosed
EP-3526212-B1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AG (DE) 2021-12-22 EP disclosed
EP-3526212-B1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AG (DE) 2021-12-22 EP disclosed
US-20200055842-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2020-02-20 US disclosed
US-20200055842-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2020-02-20 US disclosed
WO-2018069222-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-04-19 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 (3 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-11208400-B2 Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof REN, ATP6V1B1, GLS SLC34A1 1550/4885PTGIR 112/4885PTGS2 641/4885
US-20200055842-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF REN, ATP6V1B1, GLS SLC34A1 1550/4885PTGIR 112/4885PTGS2 641/4885
US-20230065629-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF REN, ATP6V1B1, GLS SLC34A1 1550/4885PTGIR 112/4885PTGS2 641/4885

“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.