SCHEMBL18183584

SCHEMBL18183584

O=C(O)Nc1ccc(Cc2ccc(NC(O)O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.50
▸ LMNA P02545 3/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ SLC1A3 P43003 1/20 0.45
▸ SLC1A2 P43004 1/20 0.45
▸ SLC1A1 P43005 1/20 0.45
▸ SAE1 Q9UBE0 3/20 0.44
▸ UBA2 Q9UBT2 3/20 0.44
▸ TSHR P16473 1/20 0.44
▸ LTA4H P09960 1/20 0.42
▸ CCNC P24863 1/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39

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
SCHEMBL2762349 0.87 POLB (0.62) POLBLMNAKMT2AMEN1SLC1A3
SCHEMBL3773254 0.81 SLC1A3 (0.58) POLBLMNAKMT2AMEN1SLC1A3
SCHEMBL28945385 0.78 ALDH1A1 (0.53) POLBLMNAKMT2AMEN1HPGD
SCHEMBL4683087 0.78 MAPT (0.55) POLBLMNAKMT2AMEN1SLC1A3
SCHEMBL15278098 0.76 POLB (0.51) POLBLMNAKMT2AMEN1SLC1A3
Phenol SCHEMBL663964 0.76 MAOA (0.53) POLBLMNAKMT2AMEN1SLC1A3
SCHEMBL29135460 0.75 PLA2G10 (0.65) POLBLMNAKMT2AMEN1SLC1A3
SCHEMBL12604863 0.75 POLB (0.50) POLBLMNAKMT2AMEN1SLC1A3
SCHEMBL18183585 0.75 SMN1; SMN2 (0.56) POLBLMNAKMT2AMEN1SAE1
SCHEMBL29092627 0.74 POLB (0.50) POLBHPGDALDH1A1NPC1

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-20160312151-A1 Methods of Fractionating Metathesized Triacylglycerol Polyols and Uses Thereof TRENT UNIVERSITY (CA) 2016-10-27 — — US disclosed
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