SCHEMBL3013339

SCHEMBL3013339

Cc1ccc(Oc2ccc(C(N)=O)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 14/20 0.79
PARP15 Q460N3 4/20 0.79
PARP4 Q9UKK3 2/20 0.79
PARP14 Q460N5 2/20 0.79
ALDH1A1 P00352 1/20 0.79
KMT2A Q03164 1/20 0.79
PARP16 Q8N5Y8 1/20 0.79
PARP11 Q9NR21 1/20 0.79
MMP13 P45452 2/20 0.61
PARP3 Q9Y6F1 1/20 0.61
PARP2 Q9UGN5 3/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
PARP1 P09874 1/20 0.61
TNKS O95271 1/20 0.59
TNKS2 Q9H2K2 1/20 0.59
TEAD4 Q15561 1/20 0.54
MAPT P10636 1/20 0.54
HPGD P15428 1/20 0.54
RAB9A P51151 1/20 0.54

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
SCHEMBL24592196 1.00 PARP10 (0.79) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL3137816 0.89 PARP10 (1.00) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL22724718 0.89 PARP10 (0.62) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL24124451 0.89 PARP10 (0.62) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL25142213 0.87 PARP10 (0.66) PARP10PARP15PARP4PARP14ALDH1A1
Terephthalamide SCHEMBL17907469 0.87 ALDH1A1 (0.62) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL76475 0.87 ALDH1A1 (0.62) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL17865518 0.86 PARP10 (0.70) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL8406724 0.86 PARP10 (0.84) PARP10PARP15PARP4PARP14ALDH1A1
SCHEMBL10416433 0.84 ALDH1A1 (0.59) PARP10PARP15PARP4PARP14ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
US-20040002521-A1 Cyclopropanecarboxylic acid amide compound and pharmaceutical use thereof AJINOMOTO CO. INC 2004-01-01 US claimed
US-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220354949-A1 NOVEL COMPOUNDS Xeniopro GmbH (DE) 2022-11-10 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
EP-1910374-A1 AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC SODIUM CHANNELS Vernalis (R&D) Limited (GB) 2008-04-16 EP disclosed
WO-2007007069-A1 AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC SODIUM CHANNELS VERNALIS (R & D) LIMITED (GB) 2007-01-18 WO disclosed
US-7098215-B2 Nitrogenous compounds and antiviral drugs containing the same KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 2006-08-29 US disclosed
US-20040157818-A1 Cxcr4-antagonistic drugs composed of nitrogen-containing compound KUREHA CORPORATION (JP) 2004-08-12 US disclosed
US-20040092556-A1 Nitrogenous compounds and antiviral drugs containing the same KUREHA CORPORATION (JP) 2004-05-13 US disclosed
EP-1389460-A1 CXCR4-ANTAGONISTIC DRUGS COMPRISING NITROGEN-CONTAINING COMPOUND Kureha Chemical Industry Co., Ltd. (JP) 2004-02-18 EP disclosed
US-20040002521-A1 Cyclopropanecarboxylic acid amide compound and pharmaceutical use thereof AJINOMOTO CO. INC 2004-01-01 US disclosed
WO-2003083063-A2 COMMON LIGAND MIMICS: NAPHTOATES TRIAD THERAPEUTICS, INC. (US) 2003-10-09 WO disclosed
EP-1273571-A1 NITROGENOUS COMPOUNDS AND ANTIVIRAL DRUGS CONTAINING THE SAME Kureha Chemical Industry Co., Ltd. (JP) 2003-01-08 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 (11 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-20040092556-A1 Nitrogenous compounds and antiviral drugs containing the same NSUN2, ZC3HAV1L, PNP PARP10 2972/4885PARP15 3515/4885PARP4 4009/4885
US-20220354949-A1 NOVEL COMPOUNDS MUSK, TYR, IKZF3 PARP10 1501/4885PARP15 2576/4885PARP4 3018/4885
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885PARP15 2818/4885PARP4 3288/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885PARP15 2818/4885PARP4 3288/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK PARP10 1897/4885PARP15 2681/4885PARP4 3046/4885
US-20040002521-A1 Cyclopropanecarboxylic acid amide compound and pharmaceutical use thereof NFKBIA, IKBKB, CHUK PARP10 2792/4885PARP15 1220/4885PARP4 2438/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885PARP15 2818/4885PARP4 3288/4885
US-20040157818-A1 Cxcr4-antagonistic drugs composed of nitrogen-containing compound CXCR4, CXCR1, CXCR2 PARP10 1107/4885PARP15 2068/4885PARP4 2542/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR PARP10 3512/4885PARP15 4342/4885PARP4 3902/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885PARP15 2818/4885PARP4 3288/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885PARP15 2818/4885PARP4 3288/4885

“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.