SCHEMBL3690973

SCHEMBL3690973

CCCC[C@H](C(=O)O)n1c(=O)c2ccccc2n(C(C)c2c[nH]c3cc(C)cc(C)c23)c1=O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 13/20 0.43
▸ POLB P06746 1/20 0.33
▸ CNR2 P34972 4/20 0.32
▸ MAPT P10636 1/20 0.32
▸ FFAR1 O14842 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ CNR1 P21554 3/20 0.32

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
SCHEMBL3690976 1.00 CMA1 (0.43) CMA1POLBCNR2MAPTFFAR1
SCHEMBL3691538 0.95 CMA1 (0.42) CMA1POLBMAPTFFAR1GPR84
SCHEMBL3691537 0.95 CMA1 (0.42) CMA1POLBMAPTFFAR1GPR84
SCHEMBL3688465 0.91 CMA1 (0.48) CMA1POLBCNR2FFAR1GPR84
SCHEMBL3685360 0.91 CMA1 (0.48) CMA1POLBCNR2FFAR1GPR84
SCHEMBL3682510 0.91 CMA1 (0.48) CMA1POLBCNR2FFAR1GPR84
SCHEMBL3689846 0.87 CMA1 (0.36) CMA1POLBMAPTFFAR1GPR84
SCHEMBL3689843 0.87 CMA1 (0.36) CMA1POLBMAPTFFAR1GPR84
SCHEMBL3681840 0.85 CMA1 (0.47) CMA1POLBFFAR1GPR84
SCHEMBL3681842 0.85 CMA1 (0.47) CMA1POLBFFAR1GPR84

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
US-8877786-B2 Substituted carbamoylmethylamino acetic acid derivatives as novel NEP inhibitors NOVARTIS AG (CH) 2014-11-04 — — US claimed
EP-2188277-B1 QUINAZOLINEDIONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2012-11-21 — — EP claimed
EP-2640375-B1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2016-05-18 — — EP disclosed
US-8993631-B2 Method of treating contrast-induced nephropathy NOVARTIS AG (CH) 2015-03-31 — — US disclosed
US-8877786-B2 Substituted carbamoylmethylamino acetic acid derivatives as novel NEP inhibitors NOVARTIS AG (CH) 2014-11-04 — — US disclosed
EP-2735561-A1 Substituted carbamoylmethylamino acetic acid derivatives as novel NEP inhibitors Novartis AG (CH) 2014-05-28 — — EP disclosed
US-20140088165-A1 Substituted carbamoylmethylamino acetic acid derivatives as novel NEP inhibitors NOVARTIS AG (CH) 2014-03-27 — — US disclosed
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-17 — — US disclosed
EP-2188277-A1 QUINAZOLINEDIONE CHYMASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2010-05-26 — — EP disclosed
WO-2009023655-A1 QUINAZOLINEDIONE CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-19 — — WO 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-20140088165-A1 Substituted carbamoylmethylamino acetic acid derivatives as novel NEP inhibitors MME, REN, AGTR1 CMA1 10/4885POLB 3974/4885CNR2 352/4885
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY REN, SERPINB1, MME CMA1 47/4885POLB 3740/4885CNR2 370/4885

“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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