SCHEMBL4952279

SCHEMBL4952279

CCCCCCCCCCCCCCCCCc1nc2ccccc2n1Cc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.78
AGTR2 P50052 4/20 0.78
PPARG P37231 6/20 0.69
LMNA P02545 2/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
PDE4A P27815 1/20 0.62
PDE4B Q07343 1/20 0.62
PDE4C Q08493 1/20 0.62
PDE4D Q08499 1/20 0.62
MAPT P10636 1/20 0.62
ALDH1A1 P00352 1/20 0.62

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
SCHEMBL9764119 0.99 AGTR1 (0.76) AGTR1AGTR2PPARGLMNAMEN1
SCHEMBL7545514 0.99 AGTR1 (0.76) AGTR1AGTR2PPARGLMNAMEN1
SCHEMBL7545509 0.99 AGTR1 (0.76) AGTR1AGTR2PPARGLMNAMEN1
SCHEMBL29411886 0.99 AGTR1 (0.76) AGTR1AGTR2PPARGLMNAMEN1
SCHEMBL28487275 0.99 AGTR1 (0.76) AGTR1AGTR2PPARGLMNAMEN1
SCHEMBL13261296 0.91 AGTR1 (0.73) AGTR1AGTR2PPARGLMNAPDE4D
SCHEMBL13508734 0.89 AGTR1 (0.71) AGTR1AGTR2PPARGLMNAPDE4D
SCHEMBL9197881 0.88 AGTR1 (1.00) AGTR1AGTR2PPARG
SCHEMBL29411883 0.87 LMNA (0.81) AGTR1AGTR2LMNAMEN1KMT2A
SCHEMBL28481747 0.87 LMNA (0.81) AGTR1AGTR2LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130210817-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT APHIDS SYNGENTA CROP PROTECTION LLC (US) 2013-08-15 US disclosed
EP-2002722-A1 Methods of controlling insects Syngeta Participations AG (CH) 2008-12-17 EP disclosed
CN-1045907-A Improve the insecticides of effect CIBA GEIGY AG (CH) 1990-10-10 CN disclosed
EP-0210129-B1 GRAFT POLYMER SOLUBLE OR DISPERSIBLE IN WATER, ITS PREPARATION AND USE CIBA-GEIGY AG (CH) 1990-04-18 EP disclosed
EP-0210952-B1 AQUEOUS, ALKALINE, SILICATE-CONTAINING COMPOSITION FOR THE BLEACHING OF CELLULOSIC FIBRES IN THE PRESENCE OF PERCOMPOUNDS CIBA-GEIGY AG (CH) 1989-08-23 EP disclosed
EP-0293807-A2 Solid formulation of anionic dyes CIBA-GEIGY AG (CH) 1988-12-07 EP disclosed
EP-0210952-A1 Aqueous, alkaline, silicate-containing composition for the bleaching of cellulosic fibres in the presence of percompounds CIBA-GEIGY AG (CH) 1987-02-04 EP disclosed
EP-0210132-A1 Aqueous, alkaline, silicate-containing composition for the bleaching of cellulosic fibres in the presence of percompounds CIBA-GEIGY AG (CH) 1987-01-28 EP disclosed
EP-0098803-A1 Water-soluble or dispersible graft polymers, their production and use CIBA-GEIGY AG (CH) 1984-01-18 EP disclosed
US-4105401-A Dye preparation soluble in cold water CIBA-GEIGY CORPORATION (US) 1978-08-08 US disclosed
US-4062796-A CATIONIC SURFACTANT, SODIUM ACRYLATE HOMOPOLYMER HALLIBURTON COMPANY (US) 1977-12-13 US disclosed
US-3984594-A Method for producing cellulosic fiber-containing yarns with a non-aqueous sizing solution KANEBO, LTD. (JA) 1976-10-05 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-20130210817-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT APHIDS HCN3, PNN, HCN1 AGTR1 1279/4885AGTR2 992/4885PPARG 3367/4885

“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.