SCHEMBL9619967

SCHEMBL9619967

CC1(C)CC(OC(=O)c2ccccc2)CC(C)(C)S1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.68
TSHR P16473 3/20 0.59
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.51
CHRNA7 P36544 3/20 0.50
HTR3E A5X5Y0 1/20 0.50
HTR3B O95264 1/20 0.50
HTR3A P46098 1/20 0.50
HTR3D Q70Z44 1/20 0.50
HTR3C Q8WXA8 1/20 0.50
APOBEC3A P31941 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SCN1A P35498 1/20 0.44
SCN2A Q99250 1/20 0.44
SCN3A Q9NY46 1/20 0.44
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
EPHX2 P34913 1/20 0.43

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
SCHEMBL97715 0.81 GAA (1.00) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL51072 0.79 TSHR (0.70) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL294975 0.79 TSHR (0.70) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL243559 0.79 TSHR (0.70) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL9619997 0.79 GAA (0.66) GAATSHRKMT2AMEN1CHRNA7
Hydrochloric Acid SCHEMBL27993291 0.79 GAA (0.97) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL11670778 0.78 GAA (0.64) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL19720352 0.78 TSHR (0.68) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL9619995 0.78 GAA (0.64) GAATSHRKMT2AMEN1CHRNA7
SCHEMBL28220539 0.78 GAA (0.94) GAATSHRKMT2AMEN1CHRNA7

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-5149828-A Tetrahydropyran compounds CIBA-GEIGY AG (CH) 1992-09-22 US disclosed
EP-0310552-B1 STABILIZERS FOR COLOUR PHOTOGRAPHIC RECORDING MATERIALS CIBA-GEIGY AG (CH) 1992-05-13 EP disclosed
US-4933271-A Stabilizers for color photography recording materials CIBA-GEIGY AG (CH) 1990-06-12 US disclosed
EP-0310552-A1 Stabilizers for colour photographic recording materials CIBA-GEIGY AG (CH) 1989-04-05 EP disclosed