SCHEMBL10522283

SCHEMBL10522283

O=C(Oc1c2c(c(OC(=O)c3ccccc3)c3cc(Cl)ccc13)OCO2)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.42
MAPT P10636 10/20 0.41
LMNA P02545 3/20 0.41
GAA P10253 2/20 0.41
POLB P06746 1/20 0.41
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 7/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 5/20 0.38
ALDH1A1 P00352 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HSD17B10 Q99714 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 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
SCHEMBL10522294 0.92 ABCB11 (0.42) ABCB11MAPTLMNAGAAPOLB
SCHEMBL29372079 0.84 ABCB11 (0.49) ABCB11MAPTLMNAGAAPOLB
SCHEMBL10525521 0.81 ABCB11 (0.64) ABCB11MAPTGAAPOLBHTT
SCHEMBL9643565 0.80 ABCB11 (0.67) ABCB11MAPTLMNAGAAPOLB
SCHEMBL9643247 0.78 ABCB11 (0.47) ABCB11MAPTLMNAGAAPOLB
SCHEMBL10502679 0.77 ABCB11 (0.46) ABCB11MAPTLMNAGAAPOLB
SCHEMBL10523336 0.77 ABCB11 (0.46) ABCB11MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL10522819 0.77 ABCB11 (0.46) ABCB11MAPTLMNAGAAHTT
SCHEMBL10524179 0.77 ABCB11 (0.37) ABCB11MAPTLMNAGAAPOLB
SCHEMBL10503448 0.76 MAPT (0.43) ABCB11MAPTLMNAGAAPOLB

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
US-4840965-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1989-06-20 US claimed
US-4840965-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1989-06-20 US disclosed