SCHEMBL29423967

SCHEMBL29423967

Nc1ccc2[nH]c3ccccc3c(=O)c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.67
ALDH1A1 P00352 3/20 0.67
KDM4E B2RXH2 2/20 0.67
GLA P06280 2/20 0.67
HTT P42858 2/20 0.67
LMNA P02545 1/20 0.67
HPGD P15428 1/20 0.67
ATM Q13315 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
POLB P06746 3/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
PARP1 P09874 1/20 0.64
NPC1 O15118 1/20 0.64
CASP6 P55212 1/20 0.64
ABCG2 Q9UNQ0 1/20 0.58
CTSV O60911 1/20 0.57
CTSL P07711 1/20 0.57
CDK4 P11802 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
SCHEMBL29360002 1.00 GAA (0.67) GAAALDH1A1KDM4EGLAHTT
SCHEMBL354414 1.00 GAA (0.67) GAAALDH1A1KDM4EGLAHTT
SCHEMBL5342370 0.90 PARP1 (0.58) GAAALDH1A1KDM4EGLAHTT
SCHEMBL6325907 0.89 CDK4 (0.69) GAAALDH1A1KDM4EGLAHTT
SCHEMBL5335867 0.87 PARP1 (0.59) GAAALDH1A1KDM4EGLAHTT
SCHEMBL31473178 0.87 PARP1 (0.59) GAAALDH1A1KDM4EGLAHTT
SCHEMBL25791861 0.86 PARP1 (0.55) GAAALDH1A1KDM4EGLAHTT
Carbazole SCHEMBL28862120 0.84 PARP1 (0.67) GAAALDH1A1KDM4EGLAHTT
SCHEMBL29565567 0.84 PARP1 (0.67) GAAALDH1A1KDM4EGLAHTT
SCHEMBL29483487 0.84 PARP1 (0.67) GAAALDH1A1KDM4EGLAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12174197-B2 Sulfonated 2(7)-aminoacridone and 1-aminopyrene dyes and their use as fluorescent tags, in particular for carbohydrate analysis MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2024-12-24 US disclosed
US-20230040324-A1 AMINOACRIDINE AND AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2023-02-09 US disclosed
EP-4069784-A1 AMINOACRIDINE AND AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-10-12 EP disclosed
US-20220107325-A1 SULFONATED 2(7)-AMINOACRIDONE AND 1-AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2022-04-07 US disclosed
US-20220026434-A1 ADVANCED METHODS FOR AUTOMATED HIGH-PERFORMANCE IDENTIFICATION OF CARBOHYDRATES AND CARBOHYDRATE MIXTURE COMPOSITION PATTERNS AND SYSTEMS THEREFORE AS WELL AS METHODS FOR CALIBRATION OF MULTI WAVELENGTH FLUORESCENCE DETECTION SYSTEMS THEREFORE, BASED ON NEW FLUORESCENT DYES MAX-PLANCK-GESELLSCHAFT ZUR FORDUNG DER WISSENSCHAFTEN E.V. (DE) 2022-01-27 US disclosed