SCHEMBL9064480

SCHEMBL9064480

C=C1CN(c2cccc(C(F)(F)F)c2)C(=NC(=O)Oc2ccccc2)S1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
HTT P42858 1/20 0.38
NOTUM Q6P988 2/20 0.37
GRM2 Q14416 1/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
PPARD Q03181 1/20 0.36
MAPK1 P28482 3/20 0.36
MAPT P10636 2/20 0.36
MDM2 Q00987 1/20 0.36
RAB9A P51151 1/20 0.36
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
KCNH2 Q12809 1/20 0.36
FAAH O00519 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL9064479 1.00 ALDH1A1 (0.38) ALDH1A1LMNAHTTNOTUMGRM2
SCHEMBL9065120 0.84 ALDH1A1 (0.45) ALDH1A1LMNAHTTPPARGPPARA
SCHEMBL9065078 0.84 ALDH1A1 (0.45) ALDH1A1LMNAHTTPPARGPPARA
SCHEMBL9065205 0.78 LMNA (0.43) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL9065202 0.78 LMNA (0.43) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL8829652 0.71 ALDH1A1 (0.47) ALDH1A1NOTUMKMT2AMEN1MAPK1
SCHEMBL2865756 0.69 ATM (0.36) NOTUMPPARGPPARAPPARD
SCHEMBL2878921 0.68 HPGD (0.41) LMNANOTUMKMT2AMEN1MAPT
SCHEMBL2863514 0.67 HPGD (0.43) LMNANOTUMKMT2AMEN1MAPT
SCHEMBL9064745 0.66 ACACB (0.41) LMNANOTUMKMT2AMEN1MAPK1

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-5508415-A HAVING STRONG HERBICIDAL POTENCY, NOTICEABLE SELECTIVITY BETWEEN CROP PLANTS AND WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-04-16 US disclosed
US-5426188-A Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-06-20 US disclosed
EP-0446802-B1 Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL CO (JP) 1995-06-07 EP disclosed
US-5244863-A Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-09-14 US disclosed
EP-0446802-A1 Iminothiazolines, their production and use as herbicides, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-18 EP disclosed