SCHEMBL329215

SCHEMBL329215

O=S(=O)(O)c1cccc2nc3ccccc3cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
KDM4E B2RXH2 3/20 0.51
RAB9A P51151 3/20 0.51
GLA P06280 2/20 0.51
HPGD P15428 2/20 0.51
KMT2A Q03164 2/20 0.51
RCE1 Q9Y256 2/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
GAA P10253 1/20 0.51
PTBP1 P26599 1/20 0.51
MAPT P10636 1/20 0.47
ACHE P22303 1/20 0.47
TTR P02766 2/20 0.43
FABP4 P15090 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
MAPK14 Q16539 1/20 0.43
NR4A1 P22736 1/20 0.42

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
SCHEMBL30272856 1.00 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9AGLAHPGD
SCHEMBL329214 0.84 ALDH1A1 (0.53) ALDH1A1KDM4ERAB9AGLAHPGD
SCHEMBL164735 0.83 CA2 (0.59) ALDH1A1KDM4ERAB9AGLAHPGD
SCHEMBL1051623 0.83 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9AGLAHPGD
SCHEMBL642753 0.81 CA2 (0.58) ALDH1A1KDM4ERAB9AGLAHPGD
Acridine SCHEMBL28003717 0.81 CA2 (0.58) ALDH1A1KDM4ERAB9AGLAHPGD
Methane SCHEMBL28725834 0.81 CA2 (0.58) ALDH1A1KDM4ERAB9AGLAHPGD
SCHEMBL686665 0.81 TTR (0.55) ALDH1A1KDM4EKMT2APOLBGAA
SCHEMBL920170 0.81 ALDH1A1 (0.50) ALDH1A1KDM4ERAB9AGLAHPGD
SCHEMBL29843410 0.80 ALDH1A1 (0.41) ALDH1A1KDM4ERAB9AGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9292710-A None JP disclosed
EP-4366733-A1 TETRAHYDROPYRAZOLOPYRIDINE-ANALOG LIGANDS OF NLRX1 AND USES THEREOF LANDOS BIOPHARMA, INC. (US) 2024-05-15 EP 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-4225315-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING INFLAMMATORY OR IMMUNE-MEDIATED CONDITIONS OF SURFACE TISSUES Nimmune Biopharma, Inc. (US) 2023-08-16 EP disclosed
EP-4214200-A1 LANCL LIGANDS Nimmune Biopharma, Inc. (US) 2023-07-26 EP 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
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
US-7297555-B2 Hydrophilic chemiluminescent acridinium labeling reagents QUEST DIAGNOSTICS INVESTMENTS INCORPORATED (US) 2007-11-20 US disclosed
US-20050255528-A1 Hydrophilic chemiluminescent acridinium labeling reagents QUEST DIAGNOSTICS INVESTMENTS INCORPORATED 2005-11-17 US disclosed
EP-1539702-A4 HYDROPHILIC CHEMILUMINESCENT ACRIDINIUM LABELING REAGENTS QUEST DIAGNOSTICS INVEST INC (US) 2005-09-07 EP disclosed
US-6924154-B2 Hydrophilic chemilumescent acridinium labeling reagents QUEST DIAGNOSTICS INVESTMENTS INCORPORATED (US) 2005-08-02 US disclosed
EP-1539702-A2 HYDROPHILIC CHEMILUMINESCENT ACRIDINIUM LABELING REAGENTS Quest Diagnostics Investments Incorporated (US) 2005-06-15 EP disclosed
WO-2004018418-A2 HYDROPHILIC CHEMILUMINESCENT ACRIDINIUM LABELING REAGENTS QUEST DIAGNOSTICS INVESTMENTS INCORPORATED (US) 2004-03-04 WO disclosed
US-20040038294-A1 Comprises hydrophilic sulfoalkyl substituents/linkers which offset hydrophobicity of acridinium ring system; improved attachment with antibody/handling QUEST DIAGNOSTIC INVESTMENTS INCORPORATED 2004-02-26 US disclosed
JP-H09292710-A WATER-SOLUBLE PHOTOSENSITIVE COMPOSITION AND PRODUCTION OF COLOR CATHODE RAY TUBE USING THAT HITACHI LTD 1997-11-11 JP 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 ALDH1A1 4043/4885KDM4E 4410/4885RAB9A 1425/4885
US-20230167083-A1 LANCL LIGANDS LANCL2, LANCL1, LCLAT1 ALDH1A1 4156/4885KDM4E 3554/4885RAB9A 3013/4885
US-20230192652-A1 PLXDC2 LIGANDS PLP2, PDCD1LG2, LCP2 ALDH1A1 3872/4885KDM4E 3914/4885RAB9A 2749/4885
US-20050255528-A1 Hydrophilic chemiluminescent acridinium labeling reagents CTH, CBS, AHCY ALDH1A1 1709/4885KDM4E 4666/4885RAB9A 4306/4885
US-20040038294-A1 Comprises hydrophilic sulfoalkyl substituents/linkers which offset hydrophobicity of acridinium ring system; improved attachment with antibody/handling CTH, CBS, TST ALDH1A1 2567/4885KDM4E 4312/4885RAB9A 4353/4885

“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.