SCHEMBL28178407

SCHEMBL28178407

CCCCCCCCOC1(C)CCCN(C)C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.36
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 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
SCHEMBL3262372 0.98 LTA4H (0.33) LTA4H
Methane SCHEMBL27608975 0.97 LTA4H (0.33) LTA4H
SCHEMBL3624068 0.86
SCHEMBL28996827 0.74
SCHEMBL3843792 0.73 LTA4H (0.33) LTA4H
SCHEMBL6684870 0.70 LTA4H (0.33) LTA4HALDH1A1
SCHEMBL29255762 0.69 GNAI3 (0.30)
SCHEMBL22421763 0.69 NPC1 (0.39) LTA4HNPC1TP53HPGDRAB9A
SCHEMBL28996846 0.69
SCHEMBL28597081 0.67 TSHR (0.35) ALDH1A1TDP1

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
CN-107141316-B Compound, preparation method, composite catalyst and polyurethane based resin material 山东益丰生化环保股份有限公司 2019-07-09 CN disclosed
CN-107141316-A Compound, its preparation method, composite catalyst and polyurethane based resin material 山东益丰生化环保股份有限公司 2017-09-08 CN disclosed