SCHEMBL17352103

SCHEMBL17352103

C=C(CCC)C(=O)Oc1ccccc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 1/20 0.47
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTT P42858 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.41
PLIN1 O60240 1/20 0.41

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
SCHEMBL16672909 0.86 POLB (0.47) MTNR1BLMNAL3MBTL1POLBSMN1; SMN2
SCHEMBL27912002 0.85 MTNR1B (0.48) MTNR1BLMNAL3MBTL1POLBSMN1; SMN2
SCHEMBL1949303 0.83 GAA (0.43) LMNAPOLBSMN1; SMN2CA12CA1
SCHEMBL28008688 0.83 THRA (0.44) L3MBTL1MAPTKDM4EMEN1KMT2A
SCHEMBL5080574 0.83 POLB (0.47) MTNR1BLMNAL3MBTL1POLBSMN1; SMN2
SCHEMBL1792324 0.81 L3MBTL1 (0.56) MTNR1BLMNAL3MBTL1POLBSMN1; SMN2
SCHEMBL31053826 0.81 L3MBTL1 (0.56) MTNR1BLMNAL3MBTL1POLBSMN1; SMN2
SCHEMBL28008734 0.81 TDP1 (0.61) HTTMAPTALDH1A1KDM4EMEN1
SCHEMBL25823479 0.81 ALDH1A1 (0.54) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL30909436 0.80 CA1 (0.62) LMNAL3MBTL1POLBSMN1; SMN2HTT

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-20150368505-A1 ANTICORROSIVE COATING COMPOSITION, ANTICORROSIVE COATING FILM, AND METHOD FOR PREVENTING CORROSION OF SUBSTRATE CHUGOKU MARINE PAINTS, LTD. (JP) 2015-12-24 US disclosed