SCHEMBL329533

SCHEMBL329533

SC1Oc2ccccc2O1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.36
ITGB2 P05107 1/20 0.36
ICAM1 P05362 1/20 0.36
ITGAL P20701 1/20 0.36
CA2 P00918 2/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
NISCH Q9Y2I1 2/20 0.34
LMNA P02545 2/20 0.32
CRHBP P24387 2/20 0.32
CRHR2 Q13324 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ALOX5 P09917 1/20 0.32
HTT P42858 1/20 0.32
PARP1 P09874 1/20 0.31
IDO1 P14902 1/20 0.31

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
SCHEMBL23183087 0.71 NISCH (0.53) MAOAMAOBNISCHLMNASMN1; SMN2
SCHEMBL3766975 0.71 MEN1 (0.45) CA2MAOBNISCHLMNA
SCHEMBL29194950 0.69 PIM1 (0.34) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL3655783 0.69 ABCG2 (0.36) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL329447 0.69 MAOA (0.46) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL353825 0.69 PARP1 (0.40) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL8525523 0.69 POLB (0.43) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL446185 0.69 ABCG2 (0.36) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL11307666 0.69 ABCG2 (0.36) ABCG2ITGB2ICAM1ITGALCA2
SCHEMBL312107 0.69 ABCG2 (0.36) ABCG2ITGB2ICAM1ITGALCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117835980-A Tetrahydropyrazolopyridine analog ligand of NLRX1 and application thereof 朗多生物制药股份有限公司 2024-04-05 CN disclosed
EP-3927427-B1 LANTHIONINE C-LIKE PROTEIN 2 LIGANDS, CELLS PREPARED THEREWITH, AND THERAPIES USING SAME NIMMUNE BIOPHARMA INC (US) 2024-02-07 EP disclosed
US-20230357744-A1 ENGINEERED TRYPTOPHAN DECARBOXYLASES AND USES THEREOF FOR SYNTHESIZING TRYPTAMINE ANALOGS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2023-11-09 US disclosed
EP-4214200-A1 LANCL LIGANDS Nimmune Biopharma, Inc. (US) 2023-07-26 EP disclosed
CN-116368133-A NLRX1 ligand 朗多生物制药股份有限公司 2023-06-30 CN disclosed
US-20230192652-A1 PLXDC2 LIGANDS LANDOS BIOPHARMA, INC. (US) 2023-06-22 US disclosed
EP-4196475-A1 NLRX1 LIGANDS LANDOS BIOPHARMA, INC. (US) 2023-06-21 EP disclosed
US-20230167083-A1 LANCL LIGANDS LANDOS BIOPHARMA, INC. (US) 2023-06-01 US disclosed
US-20230128450-A1 NLRX1 LIGANDS LANDOS BIOPHARMA, INC. (US) 2023-04-27 US disclosed
US-11597717-B2 Substituted imidazoles as PLXDC2 ligands LANDOS BIOPHARMA, INC. (US) 2023-03-07 US disclosed
US-20090030014-A1 Indole Derivative Having Pgd2 Receptor Antagonist Activity SHIONOGI & CO., LTD. (JP) 2009-01-29 US disclosed
EP-1939175-A1 SULFONAMIDE DERIVATIVE HAVING PGD2 RECEPTOR ANTAGONISTIC ACTIVITY Shionogi&Co., Ltd. (JP) 2008-07-02 EP disclosed
EP-1932839-A1 INDOLECARBOXYLIC ACID DERIVATIVE HAVING PGD2 RECEPTOR ANTAGONISTIC ACTIVITY Shionogi Co., Ltd. (JP) 2008-06-18 EP disclosed
EP-1916245-A1 INDOLE DERIVATIVE HAVING PGD2 RECEPTOR ANTAGONIST ACTIVITY Shionogi Co., Ltd. (JP) 2008-04-30 EP disclosed
EP-1911759-A1 AZAINDOLE DERIVATIVE HAVING PGD2 RECEPTOR ANTAGONISTIC ACTIVITY Shionogi Co., Ltd. (JP) 2008-04-16 EP disclosed
EP-0938483-B1 MUSCARINIC ANTAGONISTS SCHERING CORP (US) 2003-02-26 EP disclosed
US-6043255-A ADMINISTERING TO A PATIENT SUFFERING FROM COGNITIVE DISORDER IN NEURODEGENERATIVE DISEASES A 1,4-DI-SUBSTITUTED PIPERIDINE COMPOUND SCHERING CORPORATION (US) 2000-03-28 US disclosed
EP-0938483-A2 MUSCARINIC ANTAGONISTS SCHERING CORPORATION (US) 1999-09-01 EP disclosed
US-5889006-A Muscarinic antagonists SCHERING CORPORATION (US) 1999-03-30 US disclosed
WO-1998005292-A2 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE AS MUSCARINIC ANTAGONISTS SCHERING CORPORATION (US) 1998-02-12 WO 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 (5 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-20230128450-A1 NLRX1 LIGANDS NLRP3, NLRP1, NOD1 ABCG2 2888/4885ITGB2 3226/4885ICAM1 520/4885
US-20230167083-A1 LANCL LIGANDS LANCL2, LANCL1, LCLAT1 ABCG2 2807/4885ITGB2 3933/4885ICAM1 1328/4885
US-20230192652-A1 PLXDC2 LIGANDS PLP2, PDCD1LG2, LCP2 ABCG2 3537/4885ITGB2 999/4885ICAM1 590/4885
US-11597717-B2 Substituted imidazoles as PLXDC2 ligands PLK2, PLEC, PLP2 ABCG2 1929/4885ITGB2 1074/4885ICAM1 456/4885
US-20090030014-A1 Indole Derivative Having Pgd2 Receptor Antagonist Activity HRH2, PTGDR, CNR2 ABCG2 320/4885ITGB2 3549/4885ICAM1 2571/4885

“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.