SCHEMBL3133676

SCHEMBL3133676

CN(C(=O)CNC(=O)c1cc(O)ccc1N)C1CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PYGL P06737 10/20 0.47
CCR2 P41597 5/20 0.41
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 1/20 0.38
PRMT3 O60678 1/20 0.38
KLF5 Q13887 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL3131999 0.80 PDE4A (0.42) PYGLKDM4EMEN1ALDH1A1KMT2A
SCHEMBL3131217 0.78 PYGL (0.39) PYGLCCR2KDM4EMEN1ALDH1A1
SCHEMBL3133689 0.77 CCR2 (0.52) CCR2KDM4EALDH1A1GAAHSD17B10
SCHEMBL17774898 0.77 NAAA (0.42) CCR2KDM4EMEN1ALDH1A1KMT2A
SCHEMBL3122618 0.73 CCR2 (0.52) CCR2ALDH1A1RAB9A
SCHEMBL6887760 0.73 NAAA (0.48) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1628215 0.71 F10 (0.37) PYGLCCR2HPGD
SCHEMBL3138266 0.71 ESRRG (0.43) CCR2KDM4EALDH1A1
SCHEMBL3131265 0.71 ALOX5 (0.41) CCR2
SCHEMBL3132946 0.70 KDM4E (0.43) CCR2KDM4EALDH1A1KMT2AGAA

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
US-7807686-B2 2-(4-oxo-4H-quinazolin-3-yl)acetamides and their use as vasopressin V3 antagonists N.V. ORGANON (NL) 2010-10-05 US disclosed
EP-1861380-B1 2-(4-OXO-4H-QUINAZOLIN-3-YL)ACETAMIDES AND THEIR USE AS VASOPRESSIN V3 ANTAGONISTS ORGANON NV (NL) 2010-07-07 EP disclosed
US-20080214553-A1 2-(4-Oxo-4H-Quinazolin-3-Yl) Acetamides and Their Use as Vasopressin V3 Antagonists MERCK SHARP & DOHME B.V. (NL) 2008-09-04 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-20080214553-A1 2-(4-Oxo-4H-Quinazolin-3-Yl) Acetamides and Their Use as Vasopressin V3 Antagonists AVPR2, AVPR1A, AVPR1B PYGL 4619/4885CCR2 1973/4885KDM4E 2703/4885

“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.