SCHEMBL850319

SCHEMBL850319

O=C(NC(Cc1c[nH]c2ccccc12)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.56
ACE P12821 3/20 0.55
FPR2 P25090 1/20 0.54
ITGB2 P05107 4/20 0.53
ICAM1 P05362 4/20 0.53
ITGAL P20701 4/20 0.53
NMBR P28336 2/20 0.52
MDM4 O15151 1/20 0.52
TP53 P04637 1/20 0.52
ECE1 P42892 2/20 0.52

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
SCHEMBL29350138 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29417397 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29350130 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL119594 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL119372 1.00 ALOX15 (0.56) ALOX15ACEFPR2ITGB2ICAM1
Water SCHEMBL6022940 0.99 ALOX15 (0.55) ALOX15ACEFPR2ITGB2ICAM1
Fluoride SCHEMBL7154596 0.99 ALOX15 (0.55) ALOX15ACEFPR2ITGB2ICAM1
SCHEMBL29903356 0.93 NMBR (0.55) ACENMBRECE1
SCHEMBL30310986 0.93 ACE (0.53) ACEECE1
SCHEMBL29903302 0.93 NMBR (0.55) ACENMBRECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242572-A1 a-CARBONYL ALKENYL ESTER PREPARATION METHOD THEREFOR AND APPLICATION THEREOF JIANGXI NORMAL UNIVERSITY (CN) 2023-08-03 US claimed
CN-116075499-A Novel dephosphorylated galectin derivatives with prodrug properties 指南针探路者有限公司 2023-05-05 CN claimed
CN-102775471-B Method for synthesizing cholecystokinin octapeptide by combining solid phase method and liquid phase method GL BIOCHEM SHANGHAI CO LTD 2013-10-30 CN claimed
CN-102775471-A Method for synthesizing cholecystokinin octapeptide by combining solid phase method and liquid phase method GL BIOCHEM SHANGHAI CO LTD 2012-11-14 CN claimed
EP-3455234-B1 SECO MACROLIDE COMPOUNDS SELVITA D O O (HR) 2026-04-01 EP disclosed
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 US disclosed
US-20240174714-A1 TREATMENT OF SKIN DISORDERS BACOBA AG (CH) 2024-05-30 US disclosed
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-23 US disclosed
CN-111655758-B Nucleic acid delivery polymers 国立大学法人东京大学 2024-03-22 CN disclosed
US-11891457-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-06 US disclosed
US-20230322743-A1 NOVEL SAFRYLAMINE DERIVATIVES HAVING PRODRUG PROPERTIES MIHKAL GMBH (CH) 2023-10-12 US disclosed
US-20230242572-A1 a-CARBONYL ALKENYL ESTER PREPARATION METHOD THEREFOR AND APPLICATION THEREOF JIANGXI NORMAL UNIVERSITY (CN) 2023-08-03 US disclosed
US-20080019993-A1 Inhibition of tumour growth LYTIX BIOPHARMA AS (NO) 2008-01-24 US disclosed
US-20080019993-A1 Inhibition of tumour growth LYTIX BIOPHARMA AS (NO) 2008-01-24 US disclosed
CN-100358584-C Novel compositions magnetic particles covered with gem-bisphosphonate derivatives GUERBET SA (FR) 2008-01-02 CN disclosed
US-7312358-B2 Pharmaceutically active sulfanilide derivatives LABORATOIRES SERONO SA (CH) 2007-12-25 US disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 US disclosed
WO-2007002639-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-04 WO disclosed
CN-1744920-A Novel magnetic particle compositions covered with gem-bisphosphonate derivatives GUERBET SA (FR) 2006-03-08 CN disclosed
US-20040072816-A1 Pharmaceutically active sulfanilide derivatives MERCK SERONO SA (CH) 2004-04-15 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 (9 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-11891457-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R ALOX15 3621/4885ACE 621/4885FPR2 190/4885
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 ALOX15 2821/4885ACE 282/4885FPR2 3112/4885
US-20230242572-A1 a-CARBONYL ALKENYL ESTER PREPARATION METHOD THEREFOR AND APPLICATION THEREOF ACSL1, ACSL4, WEE1 ALOX15 61/4885ACE 462/4885FPR2 3141/4885
US-20080019993-A1 Inhibition of tumour growth STING1, VIP, MIF ALOX15 325/4885ACE 1677/4885FPR2 312/4885
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R ALOX15 3621/4885ACE 621/4885FPR2 190/4885
US-20230322743-A1 NOVEL SAFRYLAMINE DERIVATIVES HAVING PRODRUG PROPERTIES HTR2A, HTR2C, HTR1D ALOX15 2716/4885ACE 626/4885FPR2 879/4885
US-20240174714-A1 TREATMENT OF SKIN DISORDERS HRH4, NR1H4, NR1H3 ALOX15 175/4885ACE 4153/4885FPR2 698/4885
US-20040072816-A1 Pharmaceutically active sulfanilide derivatives OXTR, AVPR2, OPRL1 ALOX15 1976/4885ACE 1265/4885FPR2 100/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R ALOX15 3621/4885ACE 621/4885FPR2 190/4885

“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.