SCHEMBL498654

SCHEMBL498654

O=Cc1ccc(-c2ccc(-c3cccs3)s2)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 1.00
ALDH1A1 P00352 4/20 0.50
GAA P10253 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPT P10636 3/20 0.50
GLA P06280 2/20 0.50
MEN1 O00255 2/20 0.50
POLB P06746 2/20 0.50
HPGD P15428 2/20 0.50
CASP1 P29466 2/20 0.50
CASP7 P55210 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HSD17B10 Q99714 2/20 0.50
USP2 O75604 1/20 0.50
THRB P10828 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
ALOX12 P18054 1/20 0.50

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
SCHEMBL16081599 1.00 DPP4 (1.00) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL223830 0.98 DPP4 (0.96) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL607254 0.83 DPP4 (0.69) DPP4ALDH1A1GAAKDM4EMAPT
SCHEMBL30375911 0.82 DPP4 (0.69) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL19721713 0.82 DPP4 (0.69) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL23611278 0.81 DPP4 (0.65) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL499333 0.81 DPP4 (0.65) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL13707354 0.81 DPP4 (0.65) DPP4ALDH1A1GAAL3MBTL1KDM4E
Alpha-Terthienyl SCHEMBL147274 0.81 DPP4 (0.65) DPP4ALDH1A1GAAL3MBTL1KDM4E
SCHEMBL2742433 0.81 DPP4 (0.65) DPP4ALDH1A1GAAL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2976347-B1 METAL-BASED COORDINATION COMPLEXES AS PHOTODYNAMIC COMPOUNDS AND THEIR USE MCFARLAND SHERRI ANN (US) 2022-01-19 EP disclosed
US-10967365-B2 Functionalized zinc oxide nanoparticles for photocatalytic water splitting COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-04-06 US disclosed
EP-2379109-B1 COMBINATION OF PHOTODYNAMIC THERAPY AND ANTI-VEGF AGENTS IN THE TREATMENT OF UNWANTED CHOROIDAL NEOVASCULATURE BAUSCH HEALTH COMPANIES INC (CA) 2020-10-07 EP disclosed
US-20200290033-A1 FUNCTIONALIZED ZINC OXIDE NANOPARTICLES FOR PHOTOCATALYTIC WATER SPLITTING COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-09-17 US disclosed
US-10766915-B2 Metal-based coordination complexes as photodynamic compounds and their use MCFARLAND SHERRI ANN (CA) 2020-09-08 US disclosed
US-10717072-B2 Functionalized zinc oxide nanoparticles for photocatalytic water splitting COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-07-21 US disclosed
EP-3653575-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER FUJIFILM Corporation (JP) 2020-05-20 EP disclosed
US-20200148538-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, AND DEVICE WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORPORATION (JP) 2020-05-14 US disclosed
US-10633252-B2 Surface-modified inorganic substance, method for manufacturing same, resin composition, thermally conductive material, and device FUJIFILM CORPORATION (JP) 2020-04-28 US disclosed
EP-2854948-B1 METAL-BASED THIOPHENE PHOTODYNAMIC COMPOUNDS AND THEIR USE MCFARLAND SHERRI ANN (CA) 2019-09-25 EP disclosed
US-5869051-A DERIVATIZED TO REACT WITH AMINO, THIOL, OR SACCHARIDE GROUPS OF CARRIER MOLECULE, SUCH AS, ANTIBODIES, PEPTIDES, HAPTAMERS, SUGARS Neri, Giovanni (IT) 1999-02-09 US disclosed
US-5753692-A PLANT EXTRACTS, IMMUNOSTIMULANTS TREATING IMMUNODEFICIENCY DISEASES INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1998-05-19 US disclosed
US-5747525-A ANTITUMOR AGENTS OF OLIGOMERS OF THIOPHENE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1998-05-05 US disclosed
US-5602170-A ADMINISTERING ANTIIFLAMMATORY AGENT INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1997-02-11 US disclosed
EP-0454204-B1 Method for the photochemical isomeration of organic compounds under the influence of a photosensitizer DUPHAR INT RES (NL) 1995-06-28 EP disclosed
US-5180838-A Terthienyl compounds as insecticides HER MAJESTY THE QUEEN AS REPRESENTED BY THE MINISTER OF NATIONAL DEFENSE OF HER MAJESTY'S CANADIAN GOVERNMENT (CA) 1993-01-19 US disclosed
EP-0344660-B1 THIOPHENE DERIVATIVES BASF Aktiengesellschaft (DE) 1992-07-22 EP disclosed
EP-0454204-A2 Method for the photochemical isomeration of organic compounds under the influence of a photosensitizer DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1991-10-30 EP disclosed
US-5045563-A Terthienyl Compound HER MAJESTY THE QUEEN IN RIGHT OF CANADA, AS REPRESENTED BY MINISTER OF NATIONAL DEFENCE OF HER MAJESTY'S CANADIAN GOVERNMENT (CA) 1991-09-03 US disclosed
US-4937256-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1990-06-26 US 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 (1 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-10766915-B2 Metal-based coordination complexes as photodynamic compounds and their use PIN1, PPIF, PPOX DPP4 866/4885ALDH1A1 2483/4885GAA 1911/4885

“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.