SCHEMBL9801885

SCHEMBL9801885

CCCNCCCCCCCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
TSHR P16473 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HSD17B10 Q99714 1/20 0.52
PAOX Q6QHF9 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.48
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 1/20 0.43
S1PR2 O95136 5/20 0.43
S1PR4 O95977 5/20 0.43
S1PR1 P21453 5/20 0.43
S1PR3 Q99500 5/20 0.43
S1PR5 Q9H228 1/20 0.43
GLA P06280 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
NAAA Q02083 1/20 0.39
ACHE P22303 1/20 0.38

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
SCHEMBL3316736 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801971 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801374 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801720 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801568 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801735 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801830 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801210 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL9801502 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL4777244 1.00 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A

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-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed