SCHEMBL27452136

SCHEMBL27452136

O=C(O)c1ccccc1-n1cccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.67
POLB P06746 1/20 0.67
APEX1 P27695 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
ALDH1A1 P00352 6/20 0.50
ALOX15 P16050 1/20 0.50
MYC P01106 4/20 0.47
NR4A1 P22736 2/20 0.47
AKR1C3 P42330 1/20 0.41
TSHR P16473 1/20 0.40
NOTUM Q6P988 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HMGB1 P09429 1/20 0.39
HPGD P15428 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 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
SCHEMBL31310197 0.76 L3MBTL1 (0.64) L3MBTL1POLBAPEX1TDP1ALDH1A1
SCHEMBL2556638 0.76 POLB (0.63) L3MBTL1POLBAPEX1TDP1ALDH1A1
SCHEMBL4628972 0.76 POLB (0.63) L3MBTL1POLBAPEX1TDP1ALDH1A1
Phthalic Acid SCHEMBL29653616 0.73 ALDH1A1 (0.93) L3MBTL1POLBAPEX1TDP1ALDH1A1
Phthalic Acid SCHEMBL1686043 0.71 ALDH1A1 (1.00) POLBALDH1A1ALOX15MYCNR4A1
Phthalic Acid SCHEMBL146125 0.71 ALDH1A1 (1.00) POLBALDH1A1ALOX15MYCNR4A1
Phthalic Acid SCHEMBL5668586 0.71 ALDH1A1 (1.00) POLBALDH1A1ALOX15MYCNR4A1
Phthalic Acid SCHEMBL1808 0.71 ALDH1A1 (1.00) POLBALDH1A1ALOX15MYCNR4A1
Phthalic Acid SCHEMBL8671920 0.71 ALDH1A1 (1.00) POLBALDH1A1ALOX15MYCNR4A1
Phthalic Acid SCHEMBL1332278 0.71 ALDH1A1 (1.00) POLBALDH1A1ALOX15MYCNR4A1

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
CN-1066449-C Tricyclic oxime ethers, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-05-30 CN disclosed
CN-1131155-A Tricyclic oxime ethers, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1996-09-18 CN disclosed