SCHEMBL626388

SCHEMBL626388

O=[C]C(CO)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CHRM1 P11229 1/20 0.41
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
PPARG P37231 7/20 0.38
PPARA Q07869 7/20 0.38
ALDH1A1 P00352 1/20 0.38
RECQL P46063 1/20 0.38
ALOX15 P16050 1/20 0.36
USP2 O75604 1/20 0.36
GAA P10253 1/20 0.36
LTA4H P09960 1/20 0.35
LMNA P02545 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL945944 0.80 CHRM1 (0.41) MEN1KMT2ACHRM1MTNR1AMTNR1B
SCHEMBL27585696 0.77 CHRM1 (0.36) MEN1KMT2ACHRM1MTNR1AMTNR1B
SCHEMBL5092064 0.77 ANPEP (0.41) CHRM1MTNR1AMTNR1BGAALMNA
SCHEMBL1500501 0.77 LTA4H (0.43) CHRM1PPARGPPARALTA4H
SCHEMBL950050 0.77 PPARG (0.41) CHRM1MTNR1AMTNR1BPPARGPPARA
SCHEMBL11578028 0.74 ALDH1A1 (0.42) MEN1KMT2ACHRM1ALDH1A1LTA4H
SCHEMBL11617114 0.74 ALDH1A1 (0.42) MEN1KMT2ACHRM1ALDH1A1LTA4H
SCHEMBL8907429 0.74 ALDH1A1 (0.42) MEN1KMT2ACHRM1ALDH1A1LTA4H
SCHEMBL4963146 0.72 MTNR1A (0.38) MEN1KMT2ACHRM1MTNR1AMTNR1B
SCHEMBL7661580 0.72 LTA4H (0.39) MEN1KMT2ACHRM1MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897392-A Aqueous solid phase peptide synthesis 多肽实验室(PPL)控股公司 2024-04-16 CN disclosed
US-20130267681-A1 CHEMICAL LIGATION BY RING OPENING OF OXO-THIOMORPHOLINES THE UNIVERSITY OF READING (GB) 2013-10-10 US disclosed
WO-2012020231-A1 CHEMICAL LIGATION BY RING OPENING OF OXO-THIOMORPHOLINES THE UNIVERSITY OF READING (GB) 2012-02-16 WO disclosed
US-7803351-B2 Blood brain barrier permeation peptides WASHINGTON UNIVERSITY (US) 2010-09-28 US disclosed
US-20090011981-A1 Novel Inhibitors of Angiogenesis K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2009-01-08 US disclosed
US-7399826-B1 Peptide for promoting healing of fractures ALI SADAT M 2008-07-15 US disclosed
EP-1812468-A2 PLATELET FACTOR 4 VARIANT 1 (PF4VAR1) RELATED INHIBITORS OF ANGIOGENESIS K.U.Leuven Research & Development (BE) 2007-08-01 EP disclosed
WO-2006026184-A9 BLOOD BRAIN BARRIER PERMEATION PEPTIDES UNIV WASHINGTON (US) 2006-05-26 WO disclosed
WO-2006029487-A2 PLATELET FACTOR 4 VARIANT 1 (PF4VAR1) RELATED INHIBITORS OF ANGIOGENESIS K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) 2006-03-23 WO disclosed
WO-2006026184-A2 BLOOD BRAIN BARRIER PERMEATION PEPTIDES WASHINGTON UNIVERSITY (US) 2006-03-09 WO disclosed
US-20060039859-A1 Blood brain barrier permeation peptides WASHINGTON UNIVERSITY 2006-02-23 US disclosed
WO-2005041998-A1 PEPTIDE FOR PROMOTING HEALING OF FRACTURES ALI SADAT M (US) 2005-05-12 WO disclosed
EP-0541340-B1 Biopolymer synthesis apparatus and method PERKIN ELMER CORP (US) 1997-07-16 EP disclosed
US-5462748-A Biopolymer synthesis apparatus and method APPLIED BIOSYSTEMS, INC. (US) 1995-10-31 US disclosed
EP-0541340-A2 Biopolymer synthesis apparatus and method THE PERKIN-ELMER CORPORATION (US) 1993-05-12 EP disclosed
US-4477660-A 7-(S)-Acylaminocephalosporin sulfones and process ELI LILLY AND COMPANY (US) 1984-10-16 US disclosed
EP-0109301-A2 7-(S)-acylaminocephalosporin sulfones and process ELI LILLY AND COMPANY (US) 1984-05-23 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 (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-20060039859-A1 Blood brain barrier permeation peptides APP, FABP7, TAP1 MEN1 813/4885KMT2A 4547/4885CHRM1 2236/4885
US-20130267681-A1 CHEMICAL LIGATION BY RING OPENING OF OXO-THIOMORPHOLINES PTMS, DNPEP, TAC3 MEN1 2130/4885KMT2A 3447/4885CHRM1 2501/4885

“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.