SCHEMBL975027

SCHEMBL975027

Cc1nc2ncnn2c(NC(C)C)c1-c1c(F)cc(F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.44
TSHR P16473 2/20 0.40
ALOX15 P16050 1/20 0.39
ENPP1 P22413 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL31020398 0.90 MAPK1 (0.42) MAPK1TSHRALOX15MEN1KMT2A
SCHEMBL974956 0.88 MAPK1 (0.41) MAPK1TSHRALOX15MEN1KMT2A
SCHEMBL976584 0.88 MAPK1 (0.41) MAPK1TSHRALOX15ENPP1MEN1
SCHEMBL31020441 0.88 MAPK1 (0.39) MAPK1TSHRALOX15ENPP1MEN1
SCHEMBL975954 0.86 MAPK1 (0.38) MAPK1TSHRALOX15MEN1KMT2A
SCHEMBL8385664 0.82 ENPP1 (0.51) MAPK1TSHRALOX15ENPP1MEN1
SCHEMBL974907 0.81 MAPK1 (0.41) MAPK1TSHRALOX15MEN1KMT2A
SCHEMBL8389574 0.80 ENPP1 (0.43) TSHRENPP1MEN1KMT2AGAA
SCHEMBL5096432 0.80 ALDH1A1 (0.47) MAPK1TSHRALOX15ENPP1MEN1
SCHEMBL975025 0.80 MBOAT4 (0.44) MAPK1TSHRALOX15ENPP1MEN1

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 44 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
EP-2531548-A1 METHOD FOR SOLUBILIZING HYDROPHOBIC ACTIVE INGREDIENTS IN AN AQUEOUS SOLUTION BASF SE (DE) 2012-12-12 EP disclosed
US-20110312497-A1 USE OF HYDROPHOBIN AS A SPREADING AGENT BASF SE (DE) 2011-12-22 US disclosed
WO-2011095449-A1 METHOD FOR SOLUBILIZING HYDROPHOBIC ACTIVE INGREDIENTS IN AN AQUEOUS SOLUTION BASF SE (DE) 2011-08-11 WO disclosed
WO-2007125041-A1 HYPERBRANCHED POLYESTERS WITH A LOW ACID NUMBER AND USE THEREOF BASF SE (DE) 2007-11-08 WO disclosed
WO-2007125028-A1 METHOD FOR SOLUBILISING HYDROPHOBIC ACTIVE SUBSTANCES IN AN AQUEOUS MEDIUM 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
EP-1756188-A1 AMPHIPHILIC POLYMER COMPOSITIONS AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2007-02-28 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
WO-2005121201-A1 AMPHIPHILIC POLYMER COMPOSITIONS AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 2005-12-22 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-20110312497-A1 USE OF HYDROPHOBIN AS A SPREADING AGENT PFN1, DSTN, CHN2 MAPK1 3589/4885TSHR 4646/4885ALOX15 2818/4885
US-20130123108-A1 ACTIVE SUBSTANCE COMPOSITION COMPRISING AT LEAST ONE NITROGEN ATOM-CONTAINING, HYPERBRANCHED POLYMER NOS1, NOS3, NPSR1 MAPK1 2382/4885TSHR 3493/4885ALOX15 2950/4885
US-20070184983-A1 Liquid pesticide compositions CBR3, BBC3, DDT MAPK1 2845/4885TSHR 992/4885ALOX15 1054/4885

“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.