SCHEMBL22280892

SCHEMBL22280892

COc1cc(-c2c(C)nn3c(C(C)C)c(C(=O)N[C@H]4CCOc5ccccc54)cnc23)cc(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.40
▸ LMNA P02545 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 5/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ NTRK1 P04629 1/20 0.35
▸ PI4KB Q9UBF8 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.34

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
SCHEMBL22281410 0.90 MAPT (0.39) MAPTLMNAALDH1A1TP53MAPK1
SCHEMBL31171095 0.89 MAPT (0.38) MAPTLMNATP53MAPK1NTRK1
SCHEMBL22280890 0.88 MAPK1 (0.37) MAPTLMNAALDH1A1TP53MAPK1
SCHEMBL22281222 0.88 MAPK1 (0.37) MAPTLMNAMAPK1NTRK1
SCHEMBL22281226 0.87 PDE2A (0.37) MAPTLMNAMAPK1NTRK1
SCHEMBL22281407 0.86 MAPT (0.38) MAPTLMNAALDH1A1TP53MAPK1
SCHEMBL22281402 0.86 MAPK1 (0.35) MAPTLMNAALDH1A1TP53MAPK1
SCHEMBL22280891 0.85 MAPK1 (0.38) MAPTLMNAMAPK1NTRK1
SCHEMBL23343385 0.85 BRD4 (0.39) MAPTMAPK1NTRK1
SCHEMBL22281403 0.85 PDE4A (0.38) MAPTLMNATP53MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11001590-B2 Pyrazolopyrimidine derivatives BAYER ANIMAL HEALTH GMBH (DE) 2021-05-11 — — US disclosed
US-10934301-B2 Pyrazolopyrimidine derivatives BAYER ANIMAL HEALTH GMBH (DE) 2021-03-02 — — US disclosed
US-20200299299-A1 NEW PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2020-09-24 — — US disclosed
US-20200239482-A1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2020-07-30 — — US 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-11001590-B2 Pyrazolopyrimidine derivatives P2RX5, RECQL, P2RX1 MAPT 4495/4885LMNA 2619/4885ALDH1A1 1228/4885
US-20200239482-A1 PYRAZOLOPYRIMIDINE DERIVATIVES P2RX5, RECQL, P2RX1 MAPT 4495/4885LMNA 2619/4885ALDH1A1 1228/4885
US-10934301-B2 Pyrazolopyrimidine derivatives P2RX5, RECQL, P2RX1 MAPT 4495/4885LMNA 2619/4885ALDH1A1 1228/4885
US-20200299299-A1 NEW PYRAZOLOPYRIMIDINE DERIVATIVES P2RX5, RECQL, P2RX1 MAPT 4346/4885LMNA 3036/4885ALDH1A1 1241/4885

“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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