SCHEMBL5373249

SCHEMBL5373249

CC(=CC1(C(=O)OC2CC(C)CCC2C(C)C)CC1(C)C)CO

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.43
CYP19A1 P11511 2/20 0.42
ALDH1A1 P00352 9/20 0.40
HPGD P15428 3/20 0.40
MAPT P10636 2/20 0.39
TSHR P16473 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
P2RX4 Q99571 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NFE2L2 Q16236 1/20 0.34

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
SCHEMBL5373244 1.00 EPHX1 (0.43) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL5365051 0.86 EPHX1 (0.44) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL5365056 0.86 EPHX1 (0.44) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL5364579 0.85 EPHX1 (0.44) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL5364576 0.85 EPHX1 (0.44) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL19900547 0.75 EPHX1 (0.55) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL1072050 0.74 EPHX1 (0.42) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL1072054 0.74 EPHX1 (0.42) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL2671169 0.73 CYP19A1 (0.64) EPHX1CYP19A1ALDH1A1HPGDMAPT
SCHEMBL27683782 0.73 CYP19A1 (0.64) EPHX1CYP19A1ALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276622-B2 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-02 US disclosed