SCHEMBL4020585

SCHEMBL4020585

CC(Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 11/20 0.63
▸ ACE P12821 10/20 0.63
▸ CPA1 P15085 1/20 0.58
▸ ACE2 Q9BYF1 1/20 0.58
▸ SRR Q9GZT4 1/20 0.57
▸ PSAT1 Q9Y617 1/20 0.57
▸ MMEL1 Q495T6 1/20 0.56
▸ PPARG P37231 1/20 0.56
▸ PPARA Q07869 1/20 0.56

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
SCHEMBL7507834 1.00 MME (0.63) MMEACECPA1ACE2SRR
SCHEMBL16948243 1.00 MME (0.63) MMEACECPA1ACE2SRR
SCHEMBL265577 0.88 CYP1A2 (0.61) CPA1
SCHEMBL65930 0.88 CYP1A2 (0.61) CPA1
SCHEMBL265135 0.88 CYP1A2 (0.61) CPA1
SCHEMBL11237591 0.88 TBXAS1 (0.59) MMEACE
SCHEMBL12258522 0.87 MME (0.54) MMEACECPA1ACE2SRR
SCHEMBL12258520 0.87 MME (0.54) MMEACECPA1ACE2SRR
SCHEMBL12258523 0.87 MME (0.54) MMEACECPA1ACE2SRR
Water SCHEMBL10936876 0.86 CYP1A2 (0.59) CPA1SRR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046119-A2 TREATMENT OF PSYCHIATRIC DISORDERS Myriad Genetics, Inc. (US) 2009-04-15 — — EP claimed
WO-2008006099-A2 TREATMENT OF PSYCHIATRIC DISORDERS MYRIAD GENETICS, INC. (US) 2008-01-10 — — WO claimed
US-8877815-B2 Substituted carbamoylcycloalkyl acetic acid derivatives as NEP NOVARTIS AG (CH) 2014-11-04 — — US disclosed
US-20130123465-A1 MONOMETHYLVALINE COMPOUNDS HAVING PHENYLALANINE SIDE-CHAIN MODIFICATIONS AT THE C-TERMINUS SEATTLE GENETICS, INC. (US) 2013-05-16 — — US disclosed
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP NOVARTIS AG (CH) 2012-05-17 — — US disclosed
US-20100256082-A1 Metallo-hydrolase inhibitors using metal binding moietes in combination with targeting moieties VIAMET PHARMACEUTICALS, INC. (US) 2010-10-07 — — US disclosed
EP-2046119-A2 TREATMENT OF PSYCHIATRIC DISORDERS Myriad Genetics, Inc. (US) 2009-04-15 — — EP disclosed
WO-2008006099-A2 TREATMENT OF PSYCHIATRIC DISORDERS MYRIAD GENETICS, INC. (US) 2008-01-10 — — WO disclosed
CN-101022810-A Novel biaromatic compounds which activate peroxisome proliferator activated receptor-like receptors and their use in cosmetic or pharmaceutical compositions GALDERMA RES & DEV (FR) 2007-08-22 — — CN disclosed
EP-1077941-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES Novo Nordisk A/S (DK) 2001-02-28 — — EP disclosed
WO-1999058501-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1999-11-18 — — WO disclosed
WO-1993012076-A1 REAGENTS FOR AUTOMATED SYNTHESIS OF PEPTIDE ANALOGS CORVAS INTERNATIONAL INC. (US) 1993-06-24 — — WO disclosed
EP-0360258-A2 Amino acid quinoline and naphthyridine derivatives ABBOTT LABORATORIES (US) 1990-03-28 — — 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 (3 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-20130123465-A1 MONOMETHYLVALINE COMPOUNDS HAVING PHENYLALANINE SIDE-CHAIN MODIFICATIONS AT THE C-TERMINUS MMAB, PTMS, DNPEP MME 463/4885ACE 2987/4885CPA1 1805/4885
US-20100256082-A1 Metallo-hydrolase inhibitors using metal binding moietes in combination with targeting moieties MMEL1, MPI, METAP1 MME 42/4885ACE 253/4885CPA1 1284/4885
US-20120122764-A1 SUBSTITUTED CARBAMOYLCYCLOALKYL ACETIC ACID DERIVATIVES AS NEP MME, REN, ECE1 MME 1/4885ACE 7/4885CPA1 106/4885

“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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