Decane

Decane

SCHEMBL8529243

CCCCCCCCCC.O=C(c1c(Cl)cccc1Cl)[PH](=O)C(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
HPGD P15428 1/20 0.41
DRD3 P35462 1/20 0.40
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
KAT5 Q92993 1/20 0.40

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
SCHEMBL27928528 0.85 PLK1 (0.41) PLK1ALDH1A1HTTMEN1MAPT
SCHEMBL27910817 0.78 PLK1 (0.53) PLK1ALDH1A1MEN1MAPTKMT2A
Decane SCHEMBL8529247 0.76 PLK1 (0.44) PLK1ALDH1A1HTTMEN1MAPT
SCHEMBL7186686 0.75 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AHPGDNPC1
SCHEMBL10060108 0.74 ALDH1A1 (0.52) ALDH1A1HPGDNPC1JAK2RAB9A
SCHEMBL4331990 0.73 PLK1 (0.42) PLK1ALDH1A1HTTMEN1MAPT
SCHEMBL18320536 0.73 TSHR (0.61) ALDH1A1MAPTATMNPC1RAB9A
SCHEMBL11650467 0.72 ALDH1A1 (0.45) PLK1ALDH1A1HTTMEN1MAPT
SCHEMBL23088991 0.72 ALDH1A1 (0.42) ALDH1A1HTTMAPTKMT2AHPGD
SCHEMBL28305688 0.72 ALDH1A1 (0.62) PLK1ALDH1A1HTTMEN1MAPT

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
US-5723512-A PHOTOINITIATORS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-03-03 US disclosed