SCHEMBL10659967

SCHEMBL10659967

CCC1CCCCC1COc1nc2ccccc2c(=O)o1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 14/20 0.62
TP53 P04637 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL6233304 0.78 ELANE (1.00) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL2077025 0.75 ELANE (0.78) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL10656661 0.74 ELANE (0.76) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL10659186 0.74 ELANE (0.65) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL2076871 0.73 ELANE (0.74) ELANETP53SMN1; SMN2MAPT
SCHEMBL10655020 0.73 ELANE (0.56) ELANE
SCHEMBL2079239 0.72 ELANE (0.68) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL12844728 0.72 ELANE (0.72) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL2078449 0.72 ELANE (0.72) ELANETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL13039558 0.72 ELANE (0.72) ELANETP53SMN1; SMN2NPC1ALDH1A1

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-4745116-A INHIBITORS OF SERINE PROTEASE SYNTEX (U.S.A.) INC. (US) 1988-05-17 US disclosed
US-4665070-A SERINE PROTEINASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1987-05-12 US disclosed