SCHEMBL24246204

SCHEMBL24246204

CC1CCC=C2CC3OC(=O)CC3CC21C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CYP19A1 P11511 2/20 0.33
▸ CYP2C19 P33261 1/20 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
SCHEMBL29380272 1.00 SMN1; SMN2 (0.34) SMN1; SMN2CYP19A1CYP2C19
SCHEMBL23106956 1.00 SMN1; SMN2 (0.34) SMN1; SMN2CYP19A1CYP2C19
SCHEMBL29382094 1.00 SMN1; SMN2 (0.34) SMN1; SMN2CYP19A1CYP2C19
SCHEMBL23106927 1.00 SMN1; SMN2 (0.34) SMN1; SMN2CYP19A1CYP2C19
SCHEMBL29377845 0.77 RECQL (0.34) CYP19A1CYP2C19
SCHEMBL24246322 0.75 MAPT (0.47) CYP2C19
SCHEMBL29383396 0.75 MAPT (0.47) CYP2C19
SCHEMBL23107237 0.75 MAPT (0.47) CYP2C19
SCHEMBL29379738 0.75 MAPT (0.47) CYP2C19
SCHEMBL23106925 0.73 CYP19A1 (0.33) CYP19A1

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
EP-3634954-B1 METHOD OF PRODUCING EPD AND ANALOGUES THEREOF VAN HAAFTEN CAROLINE (NL) 2022-02-09 — — EP disclosed
Send feedback