SCHEMBL7059201

SCHEMBL7059201

Nc1ccc(O)c(OCC2CO2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
GLA P06280 1/20 0.47
TSHR P16473 4/20 0.46
TP53 P04637 3/20 0.46
HIF1A Q16665 2/20 0.46
CYP3A4 P08684 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.43
PDE10A Q9Y233 1/20 0.40
DRD4 P21917 1/20 0.39
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
PPARG P37231 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
ALOX5 P09917 1/20 0.36

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
SCHEMBL29171362 0.85 ALDH1A1 (0.49) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL3354399 0.82 ALDH1A1 (0.46) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL4177996 0.82 ALDH1A1 (0.46) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL13515701 0.81 DRD4 (0.56) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL13515711 0.81 DRD4 (0.56) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL17885761 0.80 ALDH1A1 (0.50) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL24328865 0.80 ALDH1A1 (0.44) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL27768839 0.78 ACHE (0.41) ALDH1A1TSHRTP53HIF1ACYP3A4
SCHEMBL3699407 0.78 ALDH1A1 (0.45) ALDH1A1GLATSHRTP53HIF1A
SCHEMBL3858634 0.77 ALDH1A1 (0.66) ALDH1A1GLATSHRTP53HIF1A

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
WO-2003039849-A1 SPOOLABLE COMPOSITE TUBING WITH A CATALYTICALLY CURED MATRIX FIBERSPAR CORPORATION (US) 2003-05-15 WO disclosed
US-20030087052-A1 Spoolable composite tubing with a catalytically cured matrix CITIZENS BANK OF MASSACHUSETTS 2003-05-08 US disclosed