SCHEMBL9464211

SCHEMBL9464211

CC1(C)C2CC3CC(C2)CC1(c1cccc(O)c1O)C3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.38
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
CNR2 P34972 3/20 0.34
EPHX2 P34913 2/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
ALOX12 P18054 2/20 0.33
LMNA P02545 2/20 0.33
ALOX15 P16050 2/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL9464221 0.79 HSD11B1 (0.36) HSD11B1MEN1KMT2ACNR2EPHX2
SCHEMBL5898898 0.78 ALDH1A1 (0.37) HSD11B1MEN1KMT2ACNR2EPHX2
SCHEMBL3759976 0.75 MEN1 (0.46) MEN1KMT2AEPHX2ALDH1A1HPGD
SCHEMBL3765893 0.74 ALDH1A1 (0.39) HSD11B1MEN1KMT2AALDH1A1HPGD
SCHEMBL11547069 0.72 HSD11B1 (0.41) HSD11B1FAAH
SCHEMBL2745841 0.72 CNR2 (0.32) HSD11B1CNR2
SCHEMBL27199187 0.70 KMT2A (0.35) HSD11B1MEN1KMT2ACNR2EPHX2
SCHEMBL3757968 0.69 KMT2A (0.40) HSD11B1MEN1KMT2AEPHX2ALDH1A1
SCHEMBL27199183 0.67 HSD11B1 (0.39) HSD11B1MEN1KMT2ACNR2ALDH1A1
SCHEMBL27418461 0.66 MEN1 (0.43) HSD11B1MEN1KMT2ACNR2EPHX2

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-5093057-A None JP disclosed
JP-H0593057-A AROMATIC POLYCARBONATE COPOLYMER TEIJIN CHEM LTD 1993-04-16 JP disclosed