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SCHEMBL977034

SCHEMBL977034

CC(C)C(C)c1c(-c2c(F)cc(F)cc2F)c(Cl)nc2ncnn12

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ KDM4E B2RXH2 3/20 0.33
▸ PDE2A O00408 2/20 0.32
▸ GFER P55789 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ PKM P14618 1/20 0.32

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
SCHEMBL974955 0.86 MAPK1 (0.42) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL974974 0.85 ALDH1A1 (0.38) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL5096836 0.85 ALDH1A1 (0.36) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL7833033 0.82 ALDH1A1 (0.38) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL5096454 0.81 ALDH1A1 (0.46) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL977604 0.81 ALDH1A1 (0.36) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL3276173 0.80 ALDH1A1 (0.39) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL3608660 0.80 MAPK1 (0.37) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL1070921 0.80 ALDH1A1 (0.35) ALDH1A1KMT2ATSHRPOLBMAPK1
SCHEMBL29783525 0.80 MAPK1 (0.37) ALDH1A1KMT2ATSHRPOLBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8974806-B2 Method for producing aqueous active substance compositions of active substances that are hardly soluble in water BASF AKTIENGESELLSCHAFT (DE) 2015-03-10 — — US disclosed
US-8741324-B2 Liquid pesticide compositions BASF SE (DE) 2014-06-03 — — US disclosed
US-8728504-B2 Process for solubilizing hydrophobic active ingredients in aqueous medium BASF SE (DE) 2014-05-20 — — US disclosed
EP-2676680-A1 Use of hydrophobin polypeptides as penetration enhancers BASF SE (DE) 2013-12-25 — — EP disclosed
US-8497230-B2 Solid crop protection agents containing polyalkoxylate, method for their production and use thereof BASF AKTIENGESELLSCHAFT (DE) 2013-07-30 — — US disclosed
US-20130123108-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER BASF SE (DE) 2013-05-16 — — US disclosed
EP-1763300-B1 USE OF ETHER GROUP-CONTAINING POLYMERS AS SOLUBILIZERS BASF SE (DE) 2013-05-15 — — EP disclosed
US-20110312497-A1 USE OF HYDROPHOBIN AS A SPREADING AGENT BASF SE (DE) 2011-12-22 — — US disclosed
US-20110195844-A1 PROCESS FOR SOLUBILIZING HYDROPHOBIC ACTIVE INGREDIENTS IN AQUEOUS MEDIUM BASF SE (DE) 2011-08-11 — — US disclosed
EP-2308460-A1 Composition comprising active agents and at least one nitrogen-containing hyper-branched polymer BASF SE (DE) 2011-04-13 — — EP disclosed
EP-1879551-A2 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER BASF AKTIENGESELLSCHAFT (DE) 2008-01-23 — — EP disclosed
EP-1756188-B1 AMPHIPHILIC POLYMER COMPOSITIONS AND THEIR USE BASF AG (DE) 2007-12-05 — — EP disclosed
WO-2007125028-A1 METHOD FOR SOLUBILISING HYDROPHOBIC ACTIVE SUBSTANCES IN AN AQUEOUS MEDIUM BASF SE (DE) 2007-11-08 — — WO disclosed
WO-2007125041-A1 HYPERBRANCHED POLYESTERS WITH A LOW ACID NUMBER AND USE THEREOF BASF SE (DE) 2007-11-08 — — WO disclosed
US-20070184983-A1 Liquid pesticide compositions BASF SE (DE) 2007-08-09 — — US disclosed
EP-1773121-A1 LIQUID PESTICIDE COMPOSITIONS BASF AKTIENGESELLSCHAFT (DE) 2007-04-18 — — EP disclosed
WO-2006125647-A1 METHOD FOR DETERMINING RESIDUES IN PLASTICS BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 — — WO disclosed
WO-2006125644-A1 METHOD FOR DETERMINING PESTICIDE RESIDUES IN SOIL OR PLANT MATERIAL BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 — — WO disclosed
WO-2006087227-A2 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER BASF AKTIENGESELLSCHAFT (DE) 2006-08-24 — — WO disclosed
WO-2006002984-A1 LIQUID PESTICIDE COMPOSITIONS BASF AKTIENGESELLSCHAFT (DE) 2006-01-12 — — 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 (4 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-20110312497-A1 USE OF HYDROPHOBIN AS A SPREADING AGENT PFN1, DSTN, CHN2 ALDH1A1 3404/4885KMT2A 4413/4885TSHR 4646/4885
US-20110195844-A1 PROCESS FOR SOLUBILIZING HYDROPHOBIC ACTIVE INGREDIENTS IN AQUEOUS MEDIUM IDUA, PHOSPHO1, HDHD5 ALDH1A1 3286/4885KMT2A 1567/4885TSHR 4465/4885
US-20130123108-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER NOS1, NOS3, NPSR1 ALDH1A1 2770/4885KMT2A 3704/4885TSHR 3493/4885
US-20070184983-A1 Liquid pesticide compositions CBR3, BBC3, DDT ALDH1A1 2725/4885KMT2A 4122/4885TSHR 992/4885

“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.