SCHEMBL2384547

SCHEMBL2384547

CCOC(=O)C(=CO)c1ccc(Br)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.55
MAPT P10636 4/20 0.55
MEN1 O00255 3/20 0.55
LMNA P02545 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
S1PR4 O95977 1/20 0.55
S1PR1 P21453 1/20 0.55
MAPK1 P28482 1/20 0.55
ALDH1A1 P00352 4/20 0.44
HPGD P15428 2/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NHERF1 O14745 1/20 0.43
MAOB P27338 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
GAA P10253 2/20 0.41
CES2 O00748 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL2384544 1.00 KMT2A (0.55) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL27792518 0.88 KMT2A (0.57) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL13313529 0.83 SMN1; SMN2 (0.50) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL15084622 0.83 KMT2A (0.55) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL15084647 0.83 ALDH1A1 (0.56) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL10732850 0.83 ALDH1A1 (0.56) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL10732842 0.83 ALDH1A1 (0.56) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL23839926 0.83 MAPT (0.51) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL2383745 0.83 CYP19A1 (0.48) KMT2AMAPTMEN1LMNANPSR1
SCHEMBL2383748 0.83 CYP19A1 (0.48) KMT2AMAPTMEN1LMNANPSR1

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 9 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
EP-1175407-B1 PESTICIDAL PYRIMIDINE-DERIVATIVES NOVARTIS AG (CH) 2009-12-09 EP 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
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
US-6686469-B2 TREATMENT FOR PLANT PROPAGATION MATERIAL FOR PARASITICIDES NOVARTIS ANIMAL HEALTH US, INC. 2004-02-03 US disclosed
US-20030004347-A1 Pesticidal pyrimidine-derivatives NOVARTIS ANIMAL HEALTH US, INC. 2003-01-02 US disclosed
EP-1175407-A1 PESTICIDAL PYRIMIDINE-DERIVATIVES Syngenta Participations AG (CH) 2002-01-30 EP disclosed
WO-2000066565-A1 PESTICIDAL PYRIMIDINE-DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2000-11-09 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 (3 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 KMT2A 3749/4885MAPT 1995/4885MEN1 1598/4885
US-20080214538-A1 Pyridoindolone Derivatives Substituted in the 3-Position by a Phenyl, Their Preparation and Their Application in Therapeutics PNPO, PLPBP, DPYD KMT2A 4272/4885MAPT 2131/4885MEN1 1837/4885
US-20030004347-A1 Pesticidal pyrimidine-derivatives CTRC, HCN1, DDT KMT2A 2493/4885MAPT 4660/4885MEN1 2203/4885

“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.