SCHEMBL18533705

SCHEMBL18533705

N=CC(=O)C1CCOCC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.32

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
SCHEMBL24197359 0.82 THRA (0.35)
SCHEMBL19922294 0.78 PIK3CD (0.33) PIK3CD
SCHEMBL25936320 0.76 THRA (0.47) PIK3CD
SCHEMBL18520076 0.75 CES2 (0.50)
SCHEMBL24790537 0.73 THRA (0.35)
SCHEMBL1370837 0.72
SCHEMBL16095403 0.71
SCHEMBL28822104 0.71 MAPT (0.31)
SCHEMBL18056354 0.71 PIK3CD (0.30) PIK3CD
SCHEMBL28686853 0.71 CHRNB2 (0.37) PIK3CD

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
US-9745305-B2 Modulators of methyl modifying enzymes, compositions and uses thereof CONSTELLATION PHARMACEUTICALS, INC. (US) 2017-08-29 US disclosed
EP-2970305-B1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2017-02-22 EP disclosed