SCHEMBL9244012

SCHEMBL9244012

Cc1ccccc1CON1C(C)(C)CC(OC(=O)c2ccccc2)CC1(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
KMT2A Q03164 3/20 0.55
GAA P10253 3/20 0.51
MEN1 O00255 2/20 0.42
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ESR1 P03372 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CHRNA7 P36544 3/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
HTT P42858 1/20 0.40
MAOB P27338 1/20 0.40
S1PR1 P21453 1/20 0.39
S1PR5 Q9H228 1/20 0.39
APOBEC3A P31941 1/20 0.38

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
SCHEMBL7480880 0.96 TSHR (0.56) TSHRKMT2AGAAMEN1CARM1
SCHEMBL7472992 0.93 TSHR (0.53) TSHRKMT2AGAAMEN1CARM1
SCHEMBL7562061 0.86 TSHR (0.43) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL7478103 0.85 TSHR (0.67) TSHRKMT2AGAAMEN1CARM1
SCHEMBL9043360 0.85 TSHR (0.73) TSHRKMT2AGAAMEN1CARM1
SCHEMBL9656558 0.83 KMT2A (0.44) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL7476120 0.83 TSHR (0.70) TSHRKMT2AGAAMEN1CARM1
SCHEMBL6812792 0.81 TSHR (0.58) TSHRKMT2AGAAMEN1CARM1
SCHEMBL9038816 0.81 TSHR (0.67) TSHRKMT2AGAAMEN1CARM1
SCHEMBL6299616 0.81 TSHR (0.67) TSHRKMT2AGAAMEN1CARM1

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
EP-0467850-B1 Stabilized monomer compositions CIBA GEIGY AG (CH) 1995-09-06 EP claimed
EP-0467850-A1 Stabilized monomer compositions CIBA-GEIGY AG (CH) 1992-01-22 EP claimed
EP-0467850-B1 Stabilized monomer compositions CIBA GEIGY AG (CH) 1995-09-06 EP disclosed
EP-0467844-A2 Prevention of oxidation in petrochemical extraction solvents CIBA-GEIGY AG (CH) 1992-01-22 EP disclosed
EP-0467850-A1 Stabilized monomer compositions CIBA-GEIGY AG (CH) 1992-01-22 EP disclosed