SCHEMBL11061698

SCHEMBL11061698

CCC#CCCCCCCCCCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HSD17B10 Q99714 1/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.41
PTPN7 P35236 5/20 0.40
HMGCR P04035 2/20 0.40
RAB9A P51151 1/20 0.39
RECQL P46063 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 3/20 0.34
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
SELP P16109 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL1537146 1.00 ALDH1A1 (0.46) ALDH1A1LMNAMEN1KMT2AHSD17B10
SCHEMBL4218139 1.00 ALDH1A1 (0.46) ALDH1A1LMNAMEN1KMT2AHSD17B10
SCHEMBL2594400 0.97
SCHEMBL17743846 0.93 RECQL (0.46) ALDH1A1LMNAMEN1KMT2AHSD17B10
SCHEMBL2710123 0.89
SCHEMBL8029318 0.86 ALDH1A1 (0.42) ALDH1A1LMNAMEN1KMT2AHSD17B10
SCHEMBL11674706 0.86 ALDH1A1 (0.42) ALDH1A1LMNAMEN1KMT2AHSD17B10
SCHEMBL20597518 0.86 ALDH1A1 (0.42) ALDH1A1LMNAMEN1KMT2AHSD17B10
SCHEMBL31336402 0.86 RAB9A (0.48) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL7033691 0.86 ALDH1A1 (0.42) ALDH1A1LMNAMEN1KMT2AHSD17B10

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-4440940-A HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-04-03 US disclosed