SCHEMBL6260486

SCHEMBL6260486

CCCCCC1CC(=O)[N]C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.40
NOS1 P29475 3/20 0.36
NOS2 P35228 3/20 0.36
NOS3 P29474 2/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP19A1 P11511 4/20 0.34
ALOX5 P09917 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
PPARG P37231 1/20 0.33
HLCS P50747 1/20 0.33
GBA1 P04062 1/20 0.33

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
SCHEMBL10437624 0.98 CYP1A2 (0.39) CYP1A2NOS1NOS2NOS3ALDH1A1
SCHEMBL9189340 0.98 CYP1A2 (0.39) CYP1A2NOS1NOS2NOS3ALDH1A1
SCHEMBL5145497 0.98 CYP1A2 (0.39) CYP1A2NOS1NOS2NOS3ALDH1A1
SCHEMBL11313115 0.98 CYP1A2 (0.39) CYP1A2NOS1NOS2NOS3ALDH1A1
SCHEMBL6933305 0.98 CYP1A2 (0.39) CYP1A2NOS1NOS2NOS3ALDH1A1
SCHEMBL5145224 0.98 CYP1A2 (0.39) CYP1A2NOS1NOS2NOS3ALDH1A1
SCHEMBL3265923 0.86 NOS1 (0.31) NOS1NOS2NOS3
SCHEMBL2449791 0.82 ALDH1A1 (0.47) CYP1A2ALDH1A1CYP19A1PPARG
SCHEMBL8359629 0.82 ALDH1A1 (0.47) CYP1A2ALDH1A1CYP19A1PPARG
SCHEMBL10937715 0.81 CYP1A2 (0.41) CYP1A2ALDH1A1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4578474-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1986-03-25 US claimed
EP-0042639-B1 AZIDO, IMIDO, AMIDO AND AMINO DERIVATIVES OF MERCAPTOACYL PROLINES AND PIPECOLIC ACIDS HAVING HYPOTENSIVE ACTIVITY E.R. Squibb & Sons, Inc. (US) 1984-08-22 EP claimed
EP-0042639-A2 Azido, imido, amido and amino derivatives of mercaptoacyl prolines and pipecolic acids having hypotensive activity E.R. Squibb & Sons, Inc. (US) 1981-12-30 EP claimed
US-20050272649-A1 Conjoint administration of morphogens and ACE inhibitors in treatment of chronic renal failure STRYKER CORPORATION 2005-12-08 US disclosed
EP-1578360-A2 CONJOINT ADMINISTRATION OF MORPHOGENS AND ACE INHIBITORS IN TREATMENT OF CHRONIC RENAL FAILURE Curis, Inc. (US) 2005-09-28 EP disclosed
WO-2004019876-A2 CONJOINT ADMINISTRATION OF MORPHOGENS AND ACE INHIBITORS IN TREATMENT OF CHRONIC RENAL FAILURE CURIS, INC. (US) 2004-03-11 WO disclosed
US-4578474-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1986-03-25 US disclosed
US-4497953-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1985-02-05 US disclosed
EP-0042639-B1 AZIDO, IMIDO, AMIDO AND AMINO DERIVATIVES OF MERCAPTOACYL PROLINES AND PIPECOLIC ACIDS HAVING HYPOTENSIVE ACTIVITY E.R. Squibb & Sons, Inc. (US) 1984-08-22 EP disclosed
US-4390695-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1983-06-28 US disclosed
US-4310461-A HYPTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-01-12 US disclosed
EP-0042639-A2 Azido, imido, amido and amino derivatives of mercaptoacyl prolines and pipecolic acids having hypotensive activity E.R. Squibb & Sons, Inc. (US) 1981-12-30 EP disclosed
EP-0042639-A2 Azido, imido, amido and amino derivatives of mercaptoacyl prolines and pipecolic acids having hypotensive activity E.R. Squibb & Sons, Inc. (US) 1981-12-30 EP disclosed
US-4124512-A Oil recovery by waterflooding employing succinimido aryl sulfonate surfactants MOBIL OIL CORPORATION (US) 1978-11-07 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 (1 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-20050272649-A1 Conjoint administration of morphogens and ACE inhibitors in treatment of chronic renal failure BMPR2, BMP2, BMP1 CYP1A2 1382/4885NOS1 1435/4885NOS2 832/4885

“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.