SCHEMBL8700858

SCHEMBL8700858

Nc1ccc2[nH]cnc(=O)c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.54
PRKCI P41743 1/20 0.52
MAPT P10636 3/20 0.50
KDM4E B2RXH2 2/20 0.50
RAD52 P43351 1/20 0.50
MAPKAPK2 P49137 1/20 0.42
RPS6KA3 P51812 1/20 0.42
CSNK2A1 P68400 1/20 0.42
PLK3 Q9H4B4 1/20 0.42
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
PNP P00491 1/20 0.40
CLK1 P49759 1/20 0.39
AR P10275 1/20 0.39
NGFR P08138 1/20 0.39
EGFR P00533 1/20 0.38
ALDH1A1 P00352 1/20 0.37
APEX1 P27695 1/20 0.37

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
SCHEMBL1663769 0.85 PRKCI (0.56) PARP1PRKCIMAPTKDM4ERAD52
SCHEMBL8622177 0.79 ACVR1 (0.46) PARP1MAPTCA12CA9HPGD
SCHEMBL1584889 0.79 PIM1 (0.56) MAPTRPS6KA3CSNK2A1HPGDCLK1
SCHEMBL2574527 0.78 LMNA (0.57) PARP1MAPTKDM4EHPGDALDH1A1
SCHEMBL2191063 0.78 PARP1 (0.54) PARP1KDM4ECYP2C19ALDH1A1
SCHEMBL1507612 0.78 PARP1 (0.54) PARP1KDM4ERPS6KA3HPGDALDH1A1
SCHEMBL216175 0.78 PARP1 (0.54) PARP1MAPTHPGDEGFRALDH1A1
SCHEMBL2191001 0.78 PARP1 (0.54) PARP1RPS6KA3CSNK2A1CA12CA9
SCHEMBL6886180 0.77 XDH (0.36) PARP1PRKCIMAPTKDM4ERAD52
SCHEMBL11584004 0.77 ATIC (0.42) PARP1PRKCIMAPTKDM4ERAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121574623-A Corrosion-resistant and wear-resistant coating for electromagnetic valve armature core of shock absorber and preparation method thereof 时硕科技(无锡)有限公司 2026-02-27 CN claimed
US-4997920-A Dyeing polyolefins CIBA-GEIGY CORPORATION (US) 1991-03-05 US claimed
US-4670486-A Polymer composition pigmented with copper or nickel complexes of ligands containing a semicarbazone moiety CIBA-GEIGY CORPORATION (US) 1987-06-02 US claimed
CN-121574623-A Corrosion-resistant and wear-resistant coating for electromagnetic valve armature core of shock absorber and preparation method thereof 时硕科技(无锡)有限公司 2026-02-27 CN disclosed
EP-4073044-B1 NEW BRAF INHIBITORS AS PARADOX BREAKERS HOFFMANN LA ROCHE (CH) 2025-02-19 EP disclosed
CN-114746405-B Novel BRAF inhibitors as anomalous breakers 豪夫迈·罗氏有限公司 2024-03-26 CN disclosed
US-20220298145-A1 BRAF INHIBITORS AS PARADOX BREAKERS HOFFMANN-LA ROCHE INC. (US) 2022-09-22 US disclosed
CN-114746405-A Novel BRAF inhibitors as paradoxical breakers 豪夫迈·罗氏有限公司 2022-07-12 CN disclosed
WO-2021116050-A1 NEW BRAF INHIBITORS AS PARADOX BREAKERS F. HOFFMANN-LA ROCHE AG (CH) 2021-06-17 WO disclosed
US-5817832-A Blue diketopyrrolopyrrole pigments CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-10-06 US disclosed
US-5409926-A Inhibiting the side effect from angioplasty surgery by administering a biphenyl methyl-6-aminoquinazolinones MERCK & CO., INC. (US) 1995-04-25 US disclosed
US-4263205-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1981-04-21 US disclosed
US-4262120-A YELLOW TO ORANGE SHADES OF GOOD FASTNESS CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
US-4220586-A FASTNESS TO LIGHT, OVER-LACQUERING, MIGRATION, WEATHERING, AND HEAT CIBA-GEIGY CORPORATION (US) 1980-09-02 US disclosed
EP-0000737-A1 Monoazo pigments of the acetoacetylamino benzimidazolone series, their preparation and their use for colouring organic material of high molecular weight CIBA-GEIGY AG (CH) 1979-02-21 EP disclosed
US-4116959-A ISOINDOLINE PIGMENTS CIBA-GEIGY CORPORATION (US) 1978-09-26 US disclosed
US-4088641-A YELLOW TO RED SHADES CIBA-GEIGY CORPORATION (US) 1978-05-09 US disclosed
US-4052410-A YELLOW, PLASTICS, LACQUERS CIBA-GEIGY CORPORATION (US) 1977-10-04 US disclosed
US-3979386-A YELLOW, COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1976-09-07 US disclosed
US-3956266-A DISAZO DYES CIBA-GEIGY CORPORATION (US) 1976-05-11 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-20220298145-A1 BRAF INHIBITORS AS PARADOX BREAKERS BRAF, NRAS, RAF1 PARP1 616/4885PRKCI 298/4885MAPT 3939/4885

“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.