Sugi Predict

Sugi Predict / Compounds / 1,6-Hexanediol

1,6-Hexanediol

1,6-Hexanediol

SCHEMBL9164328

CN(c1nc(NCC(=O)O)nc(N(C)C2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1.CN(c1nc(NCC(=O)O)nc(N(C)C2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1.OCCCCCCO

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.37
▸ KCNH2 Q12809 1/20 0.31
▸ GAA P10253 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
SCHEMBL9091437 1.00 ALOX15 (0.37) ALOX15KCNH2GAA
1,4-Butanediol SCHEMBL9155217 0.99 ALOX15 (0.37) ALOX15KCNH2GAA
1,4-Butanediol SCHEMBL9088608 0.86 ALOX15 (0.32) ALOX15
1,4-Butanediol SCHEMBL9090710 0.83 ALOX15 (0.30) ALOX15
SCHEMBL9091419 0.81 GAA (0.36) ALOX15KCNH2GAA
SCHEMBL9164287 0.81 GAA (0.36) ALOX15KCNH2GAA
Ethylene Glycol SCHEMBL9157891 0.81 ALOX15 (0.33) ALOX15
SCHEMBL9089687 0.81 CDK1 (0.36) ALOX15KCNH2GAA
SCHEMBL9155195 0.80 GAA (0.37) ALOX15KCNH2GAA
Ethylene Glycol SCHEMBL9275711 0.80 ALOX15 (0.31) ALOX15

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
EP-0314472-B1 Novel piperidyl-triazine derivatives and their use as polymer stabilizers SANKYO CO (JP) 1994-06-22 — — EP claimed
US-5446144-A Heat and light resistance SANKYO COMPANY, LIMITED (JP) 1995-08-29 — — US disclosed