SCHEMBL9064743

SCHEMBL9064743

COC(=O)N=c1sc(C)cn1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.44
SCN2B O60939 2/20 0.41
SCN1B Q07699 2/20 0.41
SCN5A Q14524 2/20 0.41
SCN9A Q15858 2/20 0.41
SCN1A P35498 1/20 0.41
NOTUM Q6P988 1/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
POLB P06746 2/20 0.39
TP53 P04637 3/20 0.39
CNR1 P21554 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 3/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL9064734 0.89 CYP2C9 (0.46) CNR2NOTUMMAPTNPSR1TP53
SCHEMBL9450008 0.88 CNR2 (0.41) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL9064537 0.87 CNR2 (0.49) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL9064654 0.86 CNR2 (0.46) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL9428110 0.85 CNR2 (0.50) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL8196196 0.84 CNR2 (0.44) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL8424239 0.84 CNR2 (0.44) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL8427987 0.84 NOTUM (0.46) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL9064662 0.84 LMNA (0.43) CNR2SCN2BSCN1BSCN5ASCN9A
SCHEMBL8425428 0.83 CNR2 (0.43) CNR2SCN2BSCN1BSCN5ASCN9A

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 3 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
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