SCHEMBL26181572

SCHEMBL26181572

C=CCC(C)(CC)Cn1cccc(N)c1=O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.36
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30

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
SCHEMBL26181571 0.80 RECQL (0.42) ELANENPC1RAB9A
SCHEMBL13923526 0.70 ELANE (0.46) ELANE
SCHEMBL13075504 0.70 ELANE (0.46) ELANE
SCHEMBL20945015 0.67 ELANE (0.44) ELANENPC1RAB9A
SCHEMBL5116947 0.65 ELANE (0.48) ELANE
SCHEMBL15435537 0.65 ELANE (0.38) ELANENPC1RAB9A
SCHEMBL6302528 0.64 ELANE (0.41) ELANENPC1RAB9A
SCHEMBL25433288 0.64 ELANE (0.43) ELANERAB9A
SCHEMBL197253 0.63 ELANE (0.49) ELANERAB9A
SCHEMBL15804040 0.63 ELANE (0.46) ELANE

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
WO-2023110138-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-06-22 WO disclosed