SCHEMBL8944753

SCHEMBL8944753

CON1C(C)(C)CC(OC(=O)N(N)S(=O)(=O)c2ccccc2)CC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.38
ESR1 P03372 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CHRM4 P08173 3/20 0.36
CHRM3 P20309 3/20 0.36
GAA P10253 3/20 0.35
MEN1 O00255 1/20 0.35
CHRM5 P08912 2/20 0.34
CHRM1 P11229 2/20 0.34
MMP2 P08253 4/20 0.34
ANPEP P15144 1/20 0.34
HTT P42858 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL8944748 0.75 BCAT1 (0.45) KMT2ATSHRALDH1A1GAAMEN1
SCHEMBL7533362 0.74 TSHR (0.75) KMT2ATSHRALDH1A1ESR1HSD17B10
SCHEMBL3801964 0.74 MAPK1 (0.41) KMT2ATSHRALDH1A1GAAMMP2
SCHEMBL9589452 0.72 TSHR (0.57) KMT2ATSHRALDH1A1ESR1HSD17B10
SCHEMBL3801962 0.70 TSHR (0.46) KMT2ATSHRALDH1A1MMP2CYP2D6
SCHEMBL24385786 0.70 MMP2 (0.36) KMT2AALDH1A1CHRM4CHRM3MEN1
SCHEMBL9591172 0.69 TSHR (0.63) KMT2ATSHRALDH1A1ESR1HSD17B10
SCHEMBL24385835 0.69 MGLL (0.35) KMT2ATSHRALDH1A1MEN1MMP2
SCHEMBL24385904 0.69 GAA (0.50) KMT2ATSHRALDH1A1GAAMEN1
SCHEMBL24385815 0.68 GAA (0.35) KMT2AALDH1A1CHRM4CHRM3GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578731-A ASYMMETRICAL HYDRAZINE DERIVATIVE CIBA-GEIGY CORPORATION (US) 1996-11-26 US disclosed
US-5554754-A PHOTOSTABILIZERS CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed
US-5470980-A Light stabilizers for polymers that can be grafted to polymers CIBA-GEIGY CORPORATION (US) 1995-11-28 US disclosed
EP-0647626-A1 Azadicarboxylic acid derivatives containing hindered amine moieties as polymer stabilisers CIBA-GEIGY AG (CH) 1995-04-12 EP disclosed