SCHEMBL839840

SCHEMBL839840

CCNC(Cc1ccccc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.56
NAALAD2 Q9Y3Q0 2/20 0.55
MME P08473 2/20 0.54
FOLH1 Q04609 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ACE P12821 1/20 0.54
CPA1 P15085 1/20 0.54
ACE2 Q9BYF1 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53
LMNA P02545 1/20 0.52
CYP1A2 P05177 1/20 0.52
FPR2 P25090 6/20 0.51

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
SCHEMBL7271174 1.00 SIGMAR1 (0.56) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
SCHEMBL1958454 1.00 SIGMAR1 (0.56) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
Hydrochloric Acid SCHEMBL6953632 0.98 SIGMAR1 (0.55) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
Hydrochloric Acid SCHEMBL393424 0.98 SIGMAR1 (0.55) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
Hydrochloric Acid SCHEMBL393423 0.98 SIGMAR1 (0.55) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
Acetic Acid SCHEMBL28580204 0.95 SIGMAR1 (0.51) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
SCHEMBL28888764 0.92 NAALAD2 (0.49) SIGMAR1NAALAD2MMEFOLH1L3MBTL1
SCHEMBL25424588 0.91 MME (0.61) SIGMAR1MMEACECPA1ACE2
SCHEMBL25424592 0.91 MME (0.61) SIGMAR1MMEACECPA1ACE2
Nitric Acid SCHEMBL28598479 0.91 CPA1 (0.49) SIGMAR1NAALAD2MMEFOLH1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066409-A1 DERIVATIVE OF PENTACYCLIC TRITERPENOIDAL SAPONIN AND ITS PREPARATION METHOD AND APPLICATION SOOCHOW UNIVERSITY (CN) 2025-02-27 US claimed
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN claimed
WO-2024107038-A1 ETHYL PHENYLALANINE AMIDO COLLAGEN AND COMPOSITION CONTAINING SAME (주)한국생명과학연구소 2024-05-23 WO claimed
CN-115710232-A Compound containing triazolinone structure, preparation method thereof and application of compound as herbicide 中国农业大学 2023-02-24 CN claimed
CN-102781236-A Amino acid conjugates of quetiapine, methods of making and using the same KEMPHARM INC 2012-11-14 CN claimed
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 US disclosed
US-20250066409-A1 DERIVATIVE OF PENTACYCLIC TRITERPENOIDAL SAPONIN AND ITS PREPARATION METHOD AND APPLICATION SOOCHOW UNIVERSITY (CN) 2025-02-27 US disclosed
CN-117924173-B Aniline quaternary ammonium salt chiral phase transfer catalyst and application thereof in asymmetric alkylation catalysis of amino acid derivatives 广东工业大学 2024-07-09 CN disclosed
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN disclosed
US-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-23 US disclosed
WO-2024107038-A1 ETHYL PHENYLALANINE AMIDO COLLAGEN AND COMPOSITION CONTAINING SAME (주)한국생명과학연구소 2024-05-23 WO disclosed
WO-2024107038-A1 ETHYL PHENYLALANINE AMIDO COLLAGEN AND COMPOSITION CONTAINING SAME (주)한국생명과학연구소 2024-05-23 WO disclosed
EP-0552417-A1 Cyclic peptides and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-07-28 EP disclosed
EP-0528312-A2 Cyclic peptides and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-02-24 EP disclosed
WO-1993000108-A1 NOVEL INHIBITORS OF PLATELET AGGREGATION CORVAS INTERNATIONAL, INC. (US) 1993-01-07 WO disclosed
CN-1051555-A N-(imidazolyl) the alkyl alanine derivatives that replaces SMITHKLINE BEECHAM CORP (US) 1991-05-22 CN disclosed
EP-0412508-A1 Analogues of vasopressin, their preparation and pharmaceutical use CESKOSLOVENSKA AKADEMIE VED (CS) 1991-02-13 EP disclosed
US-4382923-A Tetrapeptide acylhydrazides, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-05-10 US disclosed
US-4337247-A ANALGESICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-06-29 US disclosed
EP-0050828-A1 Tetrapeptide acylhydrazides, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-05-05 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 (3 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-20240166689-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R SIGMAR1 4682/4885NAALAD2 236/4885MME 404/4885
US-20250066409-A1 DERIVATIVE OF PENTACYCLIC TRITERPENOIDAL SAPONIN AND ITS PREPARATION METHOD AND APPLICATION CASP4, CASP3, CASP14 SIGMAR1 1147/4885NAALAD2 3475/4885MME 4862/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R SIGMAR1 4682/4885NAALAD2 236/4885MME 404/4885

“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.