SCHEMBL11261607

SCHEMBL11261607

CCC(C)(C)c1ccc(OP(OCCCCCCCC(C)C)OCCCCCCCC(C)C)c(C(C)(C)CC)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 6/20 0.45
▸ NPSR1 Q6W5P4 5/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ MAPT P10636 4/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ HTT P42858 3/20 0.45
▸ UBE2N P61088 2/20 0.45
▸ GLA P06280 1/20 0.45
▸ MITF O75030 1/20 0.45
▸ RAD52 P43351 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ RCE1 Q9Y256 1/20 0.41
▸ APAF1 O14727 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ NOD2 Q9HC29 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ SIRT2 Q8IXJ6 2/20 0.33
▸ NPC1 O15118 1/20 0.32

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
SCHEMBL11271457 0.89 MAPK1 (0.43) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL9294353 0.84 ATM (0.34) MAPK1NPSR1SMN1; SMN2MAPTALDH1A1
SCHEMBL750445 0.84 ATM (0.34) MAPK1NPSR1SMN1; SMN2MAPTALDH1A1
SCHEMBL29443083 0.79 MAPK1 (0.54) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL133717 0.79 MAPK1 (0.54) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL9067541 0.77 MAPK1 (0.47) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL7948608 0.76 MAPK1 (0.46) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL7948622 0.76 MAPK1 (0.46) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL8394879 0.74 MAPK1 (0.49) MAPK1NPSR1SMN1; SMN2MAPTMEN1
SCHEMBL28349706 0.74 ATM (0.33) MAPK1NPSR1SMN1; SMN2MAPTATM

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-4348308-A IMPROVING COLOR STABILITY OF VINYL CHLORIDE POLYMERS ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1982-09-07 — — US disclosed
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