SCHEMBL19983135

SCHEMBL19983135

CCNC(C)CCC(C)COC

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 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
SCHEMBL7878259 0.79
SCHEMBL13798596 0.79
SCHEMBL12072033 0.79
SCHEMBL18331589 0.79
SCHEMBL25878482 0.77 SIGMAR1 (0.35) SIGMAR1
SCHEMBL15791164 0.72 TSHR (0.42)
SCHEMBL18937280 0.71 SIGMAR1 (0.32) SIGMAR1
SCHEMBL14980229 0.71 SIGMAR1 (0.38) SIGMAR1
SCHEMBL15305566 0.71
SCHEMBL28061656 0.71 PIK3CD (0.37)

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-2881394-B1 CONDENSED RING HETEROCYCLIC COMPOUND KYOWA HAKKO KIRIN CO LTD (JP) 2018-03-21 EP disclosed