SCHEMBL9466680

SCHEMBL9466680

CC(O)COC1C(C)(C)CCCCC1(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.31
UGT2B7 P16662 2/20 0.31

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
SCHEMBL7778992 0.76 UGT2B7 (0.36) UGT2B7
SCHEMBL10895685 0.73 UGT2B7 (0.32) UGT2B7
SCHEMBL10893759 0.71 PTPN1 (0.33) UGT2B7
SCHEMBL10798546 0.70
SCHEMBL12972052 0.69 UGT2B7 (0.35) UGT2B7
SCHEMBL9050501 0.68 CYP19A1 (0.33) MAPK1HSD17B10
SCHEMBL10305808 0.67 ALDH1A1 (0.32) UGT2B7
SCHEMBL10261260 0.67 MEN1 (0.30)
SCHEMBL6848370 0.67 MEN1 (0.30)
SCHEMBL17461610 0.67 MEN1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5097754-A None JP disclosed
JP-H0597754-A 1-(2,2,7,7-TETRAMETHYLCYCLOHEPTYLOXY)-2-ALKANOL AND PERFUME COMPOSITION CONTAINING THE SAME KAO CORP 1993-04-20 JP disclosed