SCHEMBL71782

SCHEMBL71782

O=C(O)[C@H](Cc1ccccc1)NC(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.56
NPSR1 Q6W5P4 1/20 0.55
FPR2 P25090 2/20 0.54
ECE1 P42892 1/20 0.54
MME P08473 2/20 0.53
CPA1 P15085 1/20 0.50
NAALAD2 Q9Y3Q0 1/20 0.50
CYP1A2 P05177 1/20 0.50
MMP2 P08253 4/20 0.49
MMP9 P14780 3/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ADAMTS4 O75173 1/20 0.49

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
SCHEMBL71781 1.00 ACE (0.56) ACENPSR1FPR2ECE1MME
SCHEMBL933401 1.00 ACE (0.56) ACENPSR1FPR2ECE1MME
SCHEMBL8823272 0.86 ACE (0.58) ACEMMECPA1NAALAD2L3MBTL1
SCHEMBL21326281 0.86 EPHX1 (0.49) ACENPSR1FPR2ECE1CPA1
SCHEMBL21326284 0.86 EPHX1 (0.49) ACENPSR1FPR2ECE1CPA1
SCHEMBL8823270 0.86 ACE (0.58) ACEMMECPA1NAALAD2L3MBTL1
SCHEMBL29022675 0.85 FPR2 (0.50) ACENPSR1FPR2MMEMMP2
SCHEMBL6402000 0.85 SLC7A5 (0.56) ACEALDH1A1
SCHEMBL6401999 0.85 SLC7A5 (0.56) ACEALDH1A1
SCHEMBL5772094 0.83 ATM (0.57) ALDH1A1L3MBTL1

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 1879 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115165948-B NMR-based Arf 6-specific guanylate exchange factor GEF activity detection method and application thereof 中国科学院合肥物质科学研究院 2025-01-10 CN claimed
EP-4274838-B1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NK CELLS BICYCLETX LTD (GB) 2024-09-25 EP claimed
US-20240108738-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NK CELLS BICYCLETX LIMITED (GB) 2024-04-04 US claimed
US-11904020-B2 Bicyclic peptide ligands specific for TREM2 BICYCLETX LIMITED (GB) 2024-02-20 US claimed
CN-117529489-A Bicyclic peptide ligands specific for NK cells 拜斯科技术开发有限公司 2024-02-06 CN claimed
EP-4308586-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR TREM2 BicycleTX Limited (GB) 2024-01-24 EP claimed
US-20240011009-A1 MODIFIED DIPEPTIDE CLEAVASES, USES THEREOF AND RELATED KITS Encodia, Inc. (US) 2024-01-11 US claimed
CN-117337295-A Bicyclic peptide ligands specific for TREM2 拜斯科技术开发有限公司 2024-01-02 CN claimed
EP-4274838-A2 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NK CELLS BicycleTx Limited (GB) 2023-11-15 EP claimed
US-20230220589-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2023-07-13 US claimed
EP-3334759-A1 LACTOFERRIN FRAGMENT FOR THE USE AS ANTIBACTERIAL AND ANTIVIRAL AGENT Farmagens Health Care Srl (IT) 2018-06-20 EP claimed
CN-108047304-A - 7 selective depressant of metalloproteinases and its preparation method and application 延边大学 2018-05-18 CN claimed
WO-2017025846-A1 LACTOFERRIN FRAGMENT FOR THE USE AS ANTIBACTERIAL AND ANTIVIRAL AGENT FARMAGENS HEALTH CARE SRL (IT) 2017-02-16 WO claimed
US-20030143664-A1 Products of manufacture and processes for peptide synthesis DIVERSA CORPORATION (US) 2003-07-31 US claimed
WO-2003048189-A2 PRODUCTS OF MANUFACTURE AND PROCESSES FOR PEPTIDE SYNTHESIS DIVERSA CORPORATION (US) 2003-06-12 WO claimed
EP-0950046-B1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS NAEJA PHARMACEUTICAL INC (CA) 2002-04-10 EP claimed
US-6232305-B1 ANTICANCER AGENTS; BONE DISORDERS; ANTIARTHRITIC AGENTS; RESPIRATORY SYSTEM DISORDERS NAEJA PHARMACEUTICAL INC. (CA) 2001-05-15 US claimed
EP-0950046-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (CA) 1999-10-20 EP claimed
WO-1999050283-A1 HIGH THROUGHPUT SCREENING ASSAYS FOR MODULATORS OF STAT4 AND STAT6 ACTIVITY TULARIK INC. (US) 1999-10-07 WO claimed
WO-1998012176-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (US) 1998-03-26 WO claimed

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-11904020-B2 Bicyclic peptide ligands specific for TREM2 APP, TIMCC, ADM2 ACE 1201/4885NPSR1 525/4885FPR2 5/4885
US-20240108738-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NK CELLS PBK, KLRK1, MICA ACE 1945/4885NPSR1 352/4885FPR2 306/4885

“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.