SCHEMBL21356341

SCHEMBL21356341

CC(=O)c1cc(-c2ncc(F)c(NC(CC(=O)O)C(C)C)n2)nn1Cc1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GUCY1B2 O75343 19/20 0.47
▸ GUCY1A2 P33402 19/20 0.47
▸ GUCY1A1 Q02108 19/20 0.47
▸ GUCY1B1 Q02153 19/20 0.47
▸ CYP2C9 P11712 1/20 0.39
▸ P2RY14 Q15391 1/20 0.37

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
SCHEMBL17620509 1.00 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL23434884 0.88 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL23787907 0.87 GUCY1B2 (0.46) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16081768 0.85 GUCY1B2 (0.50) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16906967 0.84 GUCY1B2 (0.51) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL18596926 0.84 GUCY1B2 (0.70) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16082272 0.84 GUCY1B2 (0.70) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16082271 0.84 GUCY1B2 (0.70) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL19456637 0.83 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9
SCHEMBL16906879 0.83 GUCY1B2 (0.47) GUCY1B2GUCY1A2GUCY1A1GUCY1B1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107406422-B Pyrazole derivatives as sGC stimulators 赛科理音医疗有限公司 2022-02-01 — — CN disclosed
US-20210221793-A1 PYRAZOLE DERIVATIVES AS SGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2021-07-22 — — US disclosed
US-20190284168-A1 PYRAZOLE DERIVATIES AS SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC 2019-09-19 — — 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 (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-20210221793-A1 PYRAZOLE DERIVATIVES AS SGC STIMULATORS PTGIS, GMPS, NOS3 GUCY1B2 22/4885GUCY1A2 15/4885GUCY1A1 19/4885
US-20190284168-A1 PYRAZOLE DERIVATIES AS SGC STIMULATORS PTGIS, GMPS, NOS3 GUCY1B2 23/4885GUCY1A2 15/4885GUCY1A1 16/4885

“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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