SCHEMBL20768157

SCHEMBL20768157

COc1c(C(=O)NC2CCOc3ccccc32)cnc2c(Br)c(C)nn12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 8/20 0.41
▸ BRD4 O60885 2/20 0.40
▸ CREBBP Q92793 2/20 0.40
▸ PDE2A O00408 1/20 0.39
▸ TRPV1 Q8NER1 2/20 0.38
▸ NTRK1 P04629 1/20 0.38
▸ HPGDS O60760 1/20 0.37
▸ TAS1R3 Q7RTX0 2/20 0.36
▸ TAS1R1 Q7RTX1 2/20 0.36
▸ TAS1R2 Q8TE23 2/20 0.36
▸ HTR2A P28223 1/20 0.35
▸ ADA P00813 1/20 0.35

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
SCHEMBL20768155 1.00 MAPK1 (0.41) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL20768140 0.88 BRD4 (0.41) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL19492620 0.88 BRD4 (0.41) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL19492669 0.86 KDM4C (0.38) —
SCHEMBL19464218 0.86 BRD4 (0.40) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL19464216 0.86 BRD4 (0.40) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL20768124 0.86 MAPK1 (0.40) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL19492795 0.86 MAPK1 (0.40) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL19492768 0.84 HSP90AA1 (0.40) MAPK1BRD4CREBBPPDE2ATRPV1
SCHEMBL19492494 0.75 TRPV1 (0.38) MAPK1BRD4CREBBPPDE2ATRPV1

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
EP-3442974-B1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2023-06-07 — — EP disclosed
EP-3442974-B1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2023-06-07 — — EP disclosed
CN-109071545-B Novel pyrazolopyrimidine derivatives 拜耳动物保健有限责任公司 2021-08-03 — — CN disclosed
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-10604525-B2 Pyrazolopyrimidine derivatives BAYAL ANIMAL HEALTH GMBH (DE) 2020-03-31 — — US disclosed
US-20190071447-A1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2019-03-07 — — 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 (5 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-10604525-B2 Pyrazolopyrimidine derivatives P2RX5, RECQL, P2RX1 MAPK1 3998/4885BRD4 1513/4885CREBBP 4236/4885
US-11001590-B2 Pyrazolopyrimidine derivatives P2RX5, RECQL, P2RX1 MAPK1 3964/4885BRD4 1501/4885CREBBP 4233/4885
US-20190071447-A1 PYRAZOLOPYRIMIDINE DERIVATIVES P2RX5, RECQL, P2RX1 MAPK1 3998/4885BRD4 1513/4885CREBBP 4236/4885
US-10934301-B2 Pyrazolopyrimidine derivatives P2RX5, RECQL, P2RX1 MAPK1 3964/4885BRD4 1501/4885CREBBP 4233/4885
US-20200299299-A1 NEW PYRAZOLOPYRIMIDINE DERIVATIVES P2RX5, RECQL, P2RX1 MAPK1 3487/4885BRD4 1183/4885CREBBP 3888/4885

“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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