SCHEMBL2381110

SCHEMBL2381110

Cc1ccc2[nH]c3c(cc(-c4ccc(O)cc4)c(=O)n3C)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.43
▸ MAP2K4 P45985 1/20 0.43
▸ MAPKAPK2 P49137 1/20 0.43
▸ MAPKAPK3 Q16644 1/20 0.43
▸ MAPK6 Q16659 1/20 0.43
▸ MAPKAPK5 Q8IW41 1/20 0.43
▸ WEE1 P30291 3/20 0.42
▸ CHEK1 O14757 2/20 0.42
▸ ALDH1A1 P00352 6/20 0.41
▸ KDM4E B2RXH2 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ HPGD P15428 4/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ GAA P10253 2/20 0.38

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
SCHEMBL2382552 0.88 ALDH1A1 (0.41) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL2383709 0.88 KDM4E (0.41) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6281112 0.88 KDM4E (0.41) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL3867849 0.87 KDM4E (0.50) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL2383613 0.86 ALDH1A1 (0.41) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL3444475 0.85 ACHE (0.46) MAPK1ALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL3445384 0.84 ACHE (0.45) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL5738768 0.83 KDM4E (0.37) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL2383356 0.82 ALDH1A1 (0.43) MAPK1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL2385374 0.82 KDM4E (0.41) MAPK1ALDH1A1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8012991-B2 3-(2,4-dimethoxyphenyl)-1,9-dimethyl-2-oxo-2,9-dihydro-1H-pyrido[2,3-b]indole-6-carboxylic acid; gamma-aminobutyric acid modulator; anticarcinogenic, antitumor, antiproliferative agent; amidating a 2-aminoindole with an alpha-substituted-beta-hydroxy-alkyl acrylate SANOFI-AVENTIS (FR) 2011-09-06 — — US disclosed
US-20080214538-A1 Pyridoindolone Derivatives Substituted in the 3-Position by a Phenyl, Their Preparation and Their Application in Therapeutics SANOFI-AVENTIS (FR) 2008-09-04 — — US disclosed
US-7390818-B2 Pyridoindolone derivatives substituted in the 3-position by a phenyl, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2008-06-24 — — US disclosed
EP-1556382-B1 3-PHENYL SUBSTITUTED PYRIDOINDOLONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2008-05-28 — — EP disclosed
US-20050288318-A1 Pyridoindolone derivatives substituted in the 3-position by a phenyl, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2005-12-29 — — US disclosed
EP-1556382-A1 3-PHENYL SUBSTITUTED PYRIDOINDOLONE, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2005-07-27 — — EP disclosed
WO-2004041817-A1 3-PHENYL SUBSTITUTED PYRIDOINDOLONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2004-05-21 — — 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-20050288318-A1 Pyridoindolone derivatives substituted in the 3-position by a phenyl, their preparation and their application in therapeutics PNPO, PDXK, PLPBP MAPK1 1240/4885MAP2K4 3236/4885MAPKAPK2 1343/4885
US-20080214538-A1 Pyridoindolone Derivatives Substituted in the 3-Position by a Phenyl, Their Preparation and Their Application in Therapeutics PNPO, PLPBP, DPYD MAPK1 1720/4885MAP2K4 3730/4885MAPKAPK2 1148/4885

“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.

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