SCHEMBL2854056

SCHEMBL2854056

Cc1cccc(-n2cc(C(=O)O)cn2)c1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALKBH2 Q6NS38 2/20 0.69
HPGDS O60760 1/20 0.69
MAPT P10636 2/20 0.56
HPGD P15428 2/20 0.56
HTT P42858 2/20 0.56
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
EGLN1 Q9GZT9 4/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.49
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47

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
SCHEMBL29544523 1.00 ALKBH2 (0.69) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL17365305 0.88 MAPT (0.53) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL17563306 0.84 MAPT (0.50) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL9956086 0.84 ALKBH2 (0.62) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL27575419 0.84 ALKBH2 (0.77) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL7510493 0.83 ALKBH2 (0.71) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL2860519 0.83 ALKBH2 (0.71) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL10998710 0.82 EGLN1 (0.66) ALKBH2HPGDSKEAP1NFE2L2EGLN1
SCHEMBL70281 0.82 ALKBH2 (1.00) ALKBH2HPGDSMAPTHPGDHTT
SCHEMBL3374557 0.82 ALKBH2 (0.69) ALKBH2HPGDSMAPTHPGDHTT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
US-20210206762-A1 1H-PYRROLO[2,3-B] PYRIDINE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS VERNALIS (R&D) LIMITED (GB) 2021-07-08 US disclosed
EP-3252050-A1 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS Bristol-Myers Squibb Company (US) 2017-12-06 EP disclosed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed
EP-1360489-A1 LOW AFFINITY SCREENING METHOD Graffinity Pharmaceuticals Aktiengesellschaft (DE) 2003-11-12 EP disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1305304-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS ANTAGONISTS OF A HUMAN 11CBY RECEPTOR SMITHKLINE BEECHAM PLC (GB) 2003-05-02 EP disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP disclosed
WO-2002063299-A1 LOW AFFINITY SCREENING METHOD GRAFFINITY PHARMACEUTICALS AG (DE) 2002-08-15 WO disclosed
WO-2002010146-A1 CARBOXAMIDE COMPOUNDS AND THEIR USE AS ANTAGONISTS OF A HUMAN 11CBY RECEPTOR SMITHKLINE BEECHAM P.L.C. (GB) 2002-02-07 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 (2 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK ALKBH2 4485/4885HPGDS 144/4885MAPT 4866/4885
US-20210206762-A1 1H-PYRROLO[2,3-B] PYRIDINE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS MAP4K2, MAP3K1, MAP3K19 ALKBH2 3297/4885HPGDS 1827/4885MAPT 1725/4885

“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.