SCHEMBL3188496

SCHEMBL3188496

O=CCC(NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.53
TACR1 P25103 2/20 0.53
CTRB1 P17538 2/20 0.52
CTSS P25774 3/20 0.52
CTSL P07711 2/20 0.52
CTSB P07858 2/20 0.52
IDO1 P14902 1/20 0.52
CASP1 P29466 1/20 0.51
ALDH1A1 P00352 1/20 0.51
ALOX15 P16050 1/20 0.51
KYNU Q16719 1/20 0.50

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
SCHEMBL16862505 1.00 CTSK (0.53) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL18857019 0.92 CTSK (0.52) CTSKTACR1CTSSCTSLCTSB
SCHEMBL419572 0.92 KYNU (0.60) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL13244808 0.92 KYNU (0.60) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL4425694 0.91 PPARA (0.54) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL8299708 0.91 PPARA (0.54) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL15381002 0.89 ALDH1A1 (0.58) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL25636446 0.89 ALDH1A1 (0.58) CTSKTACR1CTRB1CTSSCTSL
SCHEMBL7365937 0.87 CTSK (0.54) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL254236 0.87 CTSL (0.55) CTSKCTSSCTSLCTSBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3909962-B1 METHOD OF PRODUCING L-GLUFOSINATE CJ CHEILJEDANG CORP (KR) 2025-05-21 EP disclosed
CN-116327974-A Antibody-drug-conjugates (ADCs) with enzymatically cleavable groups 拜耳制药股份公司 2023-06-27 CN disclosed
EP-3558388-A1 ANTIBODY DRUG CONJUGATES (ADCS) HAVING ENZYMATICALLY CLEAVABLE GROUPS Bayer Pharma Aktiengesellschaft (DE) 2019-10-30 EP disclosed
EP-3558386-A1 PRODRUGS OF CYTOTOXIC ACTIVE AGENTS HAVING ENZYMATICALLY CLEAVABLE GROUPS Bayer Aktiengesellschaft (DE) 2019-10-30 EP disclosed
CN-107921288-A The targeting conjugate of KSP inhibitor 拜耳医药股份有限公司 2018-04-17 CN disclosed
CN-107921145-A The antibody drug conjugate of KSP inhibitor and anti-TWEAKR antibody(ADC) 拜耳医药股份有限公司 2018-04-17 CN disclosed
WO-2017165416-A1 PROTECTED DERIVATIVES OF 2-AMINO-4-PHOSPHOBUTANOIC ACID AGENUS INC. (US) 2017-09-28 WO disclosed
CN-106163568-A Antibody drug conjugates (ADC) containing spindle kinesin (KSP) 拜耳制药股份公司 2016-11-23 CN disclosed
US-7662960-B2 Beta-strand mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-02-16 US disclosed
US-7662960-B2 Beta-strand mimetics and method relating thereto CHOONGWAE PHARMA CORPORATION (KR) 2010-02-16 US disclosed
EP-0329606-A2 Antibiotics from myxocuccos CIBA-GEIGY AG (CH) 1989-08-23 EP disclosed