SCHEMBL2008563

SCHEMBL2008563

O=C(O)[C@H](Cc1ccc2ccccc2c1)NCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.54
MME P08473 7/20 0.54
ACE P12821 6/20 0.54
CPA1 P15085 2/20 0.54
ACE2 Q9BYF1 2/20 0.54
CA2 P00918 1/20 0.51
PIN1 Q13526 2/20 0.48
KMT2A Q03164 1/20 0.48
PTPN2 P17706 1/20 0.47
PTPN1 P18031 1/20 0.47
CDC25B P30305 1/20 0.47
ALB P02768 1/20 0.47
IL2 P60568 1/20 0.47

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
SCHEMBL27650809 1.00 SIGMAR1 (0.54) SIGMAR1MMEACECPA1ACE2
SCHEMBL2888909 0.86 MME (0.56) MMEACECPA1ACE2CA2
SCHEMBL1060389 0.86 MME (0.56) MMEACECPA1ACE2CA2
SCHEMBL27699637 0.85 MME (0.56) SIGMAR1MMEACECPA1ACE2
SCHEMBL27699635 0.85 MME (0.56) SIGMAR1MMEACECPA1ACE2
SCHEMBL1097466 0.84 MME (0.57) MMEACECPA1ACE2CA2
SCHEMBL7889581 0.83 MME (0.62) MMEACECPA1ACE2CA2
SCHEMBL839945 0.83 MME (0.62) MMEACECPA1ACE2CA2
SCHEMBL18435514 0.83 MME (0.62) MMEACECPA1ACE2CA2
SCHEMBL11241144 0.83 MME (0.56) MMEACECPA1ACE2CA2

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964601-B2 Agonist or antgonist and binders and inversion of agonist PALATIN TECHNOLOGIES, INC. (US) 2011-06-21 US disclosed
US-7807678-B2 Peptidomimetics of biologically active metallopeptides PALATIN TECHNOLOGIES, INC. (US) 2010-10-05 US disclosed
US-7732451-B2 Naphthalene-containing melanocortin receptor-specific small molecule PALATIN TECHNOLOGIES, INC. (US) 2010-06-08 US disclosed
US-7718802-B2 Agonist or antgonist and binders and inversion of agonist; use in the treatment of metabolic, immune, infection-related and melanocortin receptor mediated disorders PALATIN TECHNOLOGIES, INC. (US) 2010-05-18 US disclosed
US-7709484-B1 Substituted melanocortin receptor-specific piperazine compounds PALATIN TECHNOLOGIES, INC. (US) 2010-05-04 US disclosed
US-7655658-B2 Use of in the treatment of melanocortin receptor-associated disorders such as in treatment of anorexia, as a weight gain aid, for treatment of obesity PALATIN TECHNOLOGIES, INC. (US) 2010-02-02 US disclosed
WO-2009144432-A1 MC4-R AGONISTS FOR THE TREATMENT OF OBESITY PALATIN TECHNOLOGIES, INC. (US) 2009-12-03 WO disclosed
US-7601753-B2 Pyrrolidine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2009-10-13 US disclosed
US-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-10-08 US disclosed
US-7550602-B1 Small molecule compositions for sexual dysfunction PALATIN TECHNOLOGIES, INC. (US) 2009-06-23 US disclosed
US-20050124636-A1 Thieno [2,3-D]pyrimidine-2,4-dione melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2005-06-09 US disclosed
US-20050038230-A1 Linear and cyclic melanocortin receptor-specific peptides PALATIN TECHNOLOGIES, INC. (US) 2005-02-17 US disclosed
WO-2004098602-A1 MELANOCORTIN RECEPTOR-SPECIFIC COMPOUNDS PALATIN TECHNOLOGIES, INC. (US) 2004-11-18 WO disclosed
US-20040167201-A1 Pyrrolidine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2004-08-26 US disclosed
US-20040157264-A1 Piperazine melanocortin-specific compounds PALATIN TECHNOLOGIES, INC. (US) 2004-08-12 US disclosed
EP-1441750-A2 LINEAR AND CYCLIC MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDES Palatin Technologies, Inc. (US) 2004-08-04 EP disclosed
EP-1425029-A1 PEPTIDOMIMETICS OF BIOLOGICALLY ACTIVE METALLOPEPTIDES Palatin Technologies, Inc. (US) 2004-06-09 EP disclosed
WO-2003013571-A1 PEPTIDOMIMETICS OF BIOLOGICALLY ACTIVE METALLOPEPTIDES PALATIN TECHNOLOGIES, INC. (US) 2003-02-20 WO disclosed
WO-2003006620-A2 LINEAR AND CYCLIC MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDES PALATIN TECHNOLOGIES, INC. (US) 2003-01-23 WO disclosed
WO-2002064091-A2 MELANOCORTIN METALLOPEPTIDES FOR TREATMENT OF SEXUAL DYSFUNCTION PALATIN TECHNOLOGIES, INC. (US) 2002-08-22 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 (5 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-20040167201-A1 Pyrrolidine melanocortin-specific compounds MC3R, MC1R, MC5R SIGMAR1 211/4885MME 548/4885ACE 2918/4885
US-20040157264-A1 Piperazine melanocortin-specific compounds MC1R, MC5R, MC3R SIGMAR1 75/4885MME 1310/4885ACE 4005/4885
US-20090253713-A1 Small Molecule Compositions for Sexual Dysfunction PDE3B, PDE3A, PDE5A SIGMAR1 480/4885MME 1838/4885ACE 2813/4885
US-20050124636-A1 Thieno [2,3-D]pyrimidine-2,4-dione melanocortin-specific compounds MC1R, MC5R, MC4R SIGMAR1 842/4885MME 3870/4885ACE 3668/4885
US-20050038230-A1 Linear and cyclic melanocortin receptor-specific peptides MC1R, MC3R, MC5R SIGMAR1 535/4885MME 305/4885ACE 2267/4885

“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.