SCHEMBL3673834

SCHEMBL3673834

O=C(c1cccc(I)c1)c1cccc(I)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
PBRM1 Q86U86 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
GRM5 P41594 1/20 0.46
FASN P49327 1/20 0.45
F2 P00734 1/20 0.45
CLK1 P49759 1/20 0.44
DYRK1A Q13627 1/20 0.44
DYRK1B Q9Y463 1/20 0.44
MTOR P42345 3/20 0.44
TP53BP1 Q12888 1/20 0.44
ITGA1 P56199 1/20 0.44

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
SCHEMBL3843601 0.95 ATM (0.60) ATMTDP1L3MBTL1PBRM1ALDH1A1
SCHEMBL3839245 0.93 ATM (0.71) ATMTDP1L3MBTL1PBRM1ALDH1A1
SCHEMBL3845298 0.91 ATM (0.56) ATMTDP1L3MBTL1PBRM1ALDH1A1
SCHEMBL3838631 0.86 AKR1C3 (0.55) ATMTDP1L3MBTL1
SCHEMBL3841059 0.86 ATM (0.55) ATMTDP1L3MBTL1PBRM1ALDH1A1
SCHEMBL18079795 0.85 CES2 (0.54) HDAC1HDAC2GRM5F2MTOR
SCHEMBL3840674 0.85 POLB (0.51) ATMTDP1L3MBTL1PBRM1ALDH1A1
SCHEMBL3670492 0.84 SRD5A2 (0.53) ATMTDP1L3MBTL1ALDH1A1
SCHEMBL7455315 0.83 AKR1C3 (0.59) ATMTDP1L3MBTL1PBRM1ALDH1A1
SCHEMBL40282 0.83 CA12 (0.58) TDP1L3MBTL1ALDH1A1MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100343256-C Biaryl substituted diazabicycloalkane amides as nicotinic acetylcholine agonists ASTRAZENECA AB (SE) 2007-10-17 CN claimed
CN-1678615-A Biaryl substituted diazabicycloalkanes as nicotinic acetylcholine antagonists ASTRAZENECA AB (SE) 2005-10-05 CN claimed
CN-1675215-A Aryl-substituted diazabicycloalkanes as nicotinic acetylcholine agonists ASTRAZENECA AB (SE) 2005-09-28 CN claimed
WO-2024117245-A1 POLYARYL ETHER KETONE RESIN COMPOSITION, MOLDED ARTICLE OF SAME AND METHOD FOR PRODUCING POLYARYL ETHER KETONE RESIN COMPOSITION 本州化学工業株式会社 2024-06-06 WO disclosed
WO-2020045316-A1 MODIFIER FOR POLYMER, PRODUCTION METHOD FOR MODIFIED CONJUGATED-DIENE POLYMER, MODIFIED CONJUGATED-DIENE POLYMER, RUBBER COMPOSITION, TIRE, AND RUBBER BELT 宇部興産株式会社 2020-03-05 WO disclosed
US-10461266-B2 Luminescent compounds and methods of using same QUEEN'S UNIVERSITY AT KINGSTON (CA) 2019-10-29 US disclosed
WO-2019198607-A1 ALKENYL-GROUP-CONTAINING COMPOUND, CURABLE RESIN COMPOSITION, AND CURED OBJECT OBTAINED THEREFROM 日本化薬株式会社 2019-10-17 WO disclosed
US-10208045-B2 Aza-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-02-19 US disclosed
US-20170358761-A1 Luminescent Compounds and Methods of Using Same QUEEN'S UNIVERSITY AT KINGSTON (CA) 2017-12-14 US disclosed
US-20170358761-A1 Luminescent Compounds and Methods of Using Same QUEEN'S UNIVERSITY AT KINGSTON (CA) 2017-12-14 US disclosed
US-20160264581-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Pharmaceuticals, Inc. 2016-09-15 US disclosed
US-20030195301-A1 Polyarylene copolymers and proton-conductive membrane JSR CORPORATION (JP) 2003-10-16 US disclosed
US-20030173547-A1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR CORPORATION (JP) 2003-09-18 US disclosed
EP-1329444-A1 Halogenated aromatic compound, (co)polymer thereof, and proton-conductive membrane comprising same JSR Corporation (JP) 2003-07-23 EP disclosed
US-6555626-B2 Controlled amount of sulfonic acid groups; copolymer of an aromatic compound having a main chain containing electron withdrawing groups and aromatic compounds with no electron withdrawing groups; durability, strength, conductivity JSR CORPORATION (JP) 2003-04-29 US disclosed
US-20020172652-A1 Composition for film formation and material for insulating film formation JSR CORPORATION (JP) 2002-11-21 US disclosed
US-20020172850-A1 Polymer electrolyte membrane and solid polymer electrolyte fuel cell using same HONDA GIKEN KOGYO KABUSHIKI KAISHA, JSR CORPORATION 2002-11-21 US disclosed
EP-1245638-A1 Composition for insulating film formation JSR Corporation (JP) 2002-10-02 EP disclosed
US-20010037000-A1 Polyarylene copolymers and proton-conductive membrane JSR CORPORATION (JP) 2001-11-01 US disclosed
EP-1138712-A2 Polyarylene copolymers and proton-conductive membrane JSR Corporation (JP) 2001-10-04 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 (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-20170358761-A1 Luminescent Compounds and Methods of Using Same CRY2, CYBA, TYR ATM 1242/4885TDP1 1175/4885L3MBTL1 506/4885
US-10208045-B2 Aza-pyridone compounds and uses thereof PNPO, ITPA, PDXK ATM 2662/4885TDP1 1026/4885L3MBTL1 4081/4885
US-20160264581-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK ATM 2662/4885TDP1 1026/4885L3MBTL1 4081/4885
US-20020172652-A1 Composition for film formation and material for insulating film formation VCL, BMI1, PUF60 ATM 1417/4885TDP1 1971/4885L3MBTL1 2698/4885
US-10461266-B2 Luminescent compounds and methods of using same CRY2, CYBA, TYR ATM 1242/4885TDP1 1175/4885L3MBTL1 506/4885

“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.