SCHEMBL161255

SCHEMBL161255

CN[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
NPSR1 Q6W5P4 1/20 0.56
CYP1A2 P05177 1/20 0.55
NAALAD2 Q9Y3Q0 2/20 0.54
TAAR1 Q96RJ0 2/20 0.53
SLC18A2 Q05940 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
FOLH1 Q04609 1/20 0.53
MMP2 P08253 3/20 0.53
MMP9 P14780 2/20 0.53

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
SCHEMBL7937827 1.00 MME (0.57) MMEL3MBTL1NPSR1CYP1A2NAALAD2
SCHEMBL38479 1.00 MME (0.57) MMEL3MBTL1NPSR1CYP1A2NAALAD2
SCHEMBL38480 1.00 MME (0.57) MMEL3MBTL1NPSR1CYP1A2NAALAD2
Phosphine SCHEMBL28008446 0.98 MME (0.56) MMEL3MBTL1NPSR1CYP1A2NAALAD2
Hydrochloric Acid SCHEMBL7323325 0.98 MME (0.56) MMEL3MBTL1NPSR1CYP1A2NAALAD2
Hydrochloric Acid SCHEMBL901419 0.98 MME (0.56) MMEL3MBTL1NPSR1CYP1A2NAALAD2
Hydrochloric Acid SCHEMBL3905709 0.98 MME (0.56) MMEL3MBTL1NPSR1CYP1A2NAALAD2
SCHEMBL1324555 0.98 MME (0.56) MMEL3MBTL1NPSR1CYP1A2NAALAD2
SCHEMBL1324550 0.98 MME (0.56) MMEL3MBTL1NPSR1CYP1A2NAALAD2
Glycolic Acid SCHEMBL28512694 0.93 NAALAD2 (0.53) MMEL3MBTL1NPSR1CYP1A2NAALAD2

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

Appears in 2218 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122028793-A Fungicidal compositions 先正达农作物保护股份公司 2026-05-12 CN claimed
US-12575567-B2 Fungicidal compositions SYNGENTA CROP PROTECTION AG (CH) 2026-03-17 US claimed
US-12527322-B2 Fungicidal compositions SYNGENTA CROP PROTECTION AG (CH) 2026-01-20 US claimed
US-20260001910-A1 PEPTIDES AND USES THEREOF PREVECEUTICAL MEDICAL INC (CA) 2026-01-01 US claimed
US-20250107533-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-04-03 US claimed
WO-2025032051-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-02-13 WO claimed
WO-2025032052-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-02-13 WO claimed
WO-2025032053-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-02-13 WO claimed
US-20240391954-A1 MC4R AGONIST PEPTIDES THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2024-11-28 US claimed
EP-4433495-A1 PEPTIDES AND USES THEREOF Preveceutical Medical Inc. (CA) 2024-09-25 EP claimed
US-8802819-B2 Diketopiperazine forming dipeptidyl linker LONZA LTD. (CH) 2014-08-12 US claimed
US-20120202821-A1 CONFORMATIONALLY CONSTRAINED, FULLY SYNTHETIC MACROCYCLIC COMPOUNDS POLYPHOR AG (CH) 2012-08-09 US claimed
US-7256172-B1 Method of treatment and agents useful for same THE UNIVERSITY OF MELBOURNE (AU) 2007-08-14 US claimed
EP-0699074-B1 THROMBIN INHIBITORS MERCK & CO INC (US) 2002-11-13 EP claimed
EP-0699074-A4 THROMBIN INHIBITORS MERCK & CO INC (US) 1998-03-11 EP claimed
US-5672582-A ANTICOAGULANTS; 4-SUBSTITUTED CYCLOHEXYLAMINE DERIVATIVES MERCK & CO., INC. (US) 1997-09-30 US claimed
WO-1996011697-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 1996-04-25 WO claimed
EP-0699074-A1 THROMBIN INHIBITORS MERCK & CO. INC. (US) 1996-03-06 EP claimed
WO-1994025051-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 1994-11-10 WO claimed
EP-0556962-A1 Small peptide and pseudopeptide amides inhibiting the proliferation of small-cell and epithelial-cell lung cancer cells RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1993-08-25 EP claimed