SCHEMBL6366232

SCHEMBL6366232

CCCCc1cc(C(=O)OCC)n[nH]1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 8/20 0.68
HCAR3 P49019 2/20 0.68
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 1/20 0.45
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.44
KDM5A P29375 1/20 0.44
CYP1A2 P05177 1/20 0.42
PDE4D Q08499 1/20 0.41

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
SCHEMBL9367631 0.95 HCAR2 (0.68) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL11365652 0.94 HCAR2 (0.69) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL11400467 0.94 HCAR2 (0.69) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL11241327 0.94 HCAR2 (0.69) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL11220652 0.94 HCAR2 (0.69) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL11409554 0.94 HCAR2 (0.69) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL11231576 0.94 HCAR2 (0.69) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL1259028 0.91 HCAR2 (0.66) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL5724811 0.90 HCAR2 (0.54) HCAR2HCAR3KMT2ANPSR1L3MBTL1
SCHEMBL25466120 0.86 HCAR2 (0.50) HCAR2HCAR3KMT2ANPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638119-B Pyrazole purine herbicide safener as well as preparation method and application thereof 东北农业大学 2025-02-28 CN disclosed
CN-118638119-A Pyrazole purine herbicide safener as well as preparation method and application thereof 东北农业大学 2024-09-13 CN disclosed
US-6967204-B2 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC (US) 2005-11-22 US disclosed
US-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC 2005-03-31 US disclosed
EP-1444009-A1 TREATMENT OF INSULIN RESISTANCE SYNDROME AND TYPE 2 DIABETES WITH PDE9 INHIBITORS Pfizer Products Inc. (US) 2004-08-11 EP disclosed
US-20040023989-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors FRYBURG DAVID A (US) 2004-02-05 US disclosed
WO-2003037432-A1 TREATMENT OF INSULIN RESISTANCE SYNDROME AND TYPE 2 DIABETES WITH PDE9 INHIBITORS PFIZER PRODUCTS INC. (US) 2003-05-08 WO disclosed
EP-0411507-B1 Pyrazole derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-10-26 EP disclosed
US-5183899-A Cardiovascular disorders, hypotensive disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-02-02 US disclosed
EP-0411507-A1 Pyrazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-02-06 EP 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-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors GPR119, PDE2A, PDE9A HCAR2 1033/4885HCAR3 2113/4885KMT2A 2168/4885
US-20040023989-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors GPR119, PDE2A, PDE9A HCAR2 1033/4885HCAR3 2113/4885KMT2A 2168/4885

“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.