SCHEMBL14543827

SCHEMBL14543827

O=c1c2ccc(Cl)cc2[nH]c2cc(Cl)ccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ TP53 P04637 1/20 0.60
▸ LMNA P02545 4/20 0.58
▸ CA1 P00915 1/20 0.56
▸ CA2 P00918 1/20 0.56
▸ DAO P14920 1/20 0.55
▸ CA9 Q16790 2/20 0.55
▸ CA12 O43570 1/20 0.55
▸ GRIN2D O15399 2/20 0.54
▸ GRIN3B O60391 2/20 0.54
▸ GRIN1 Q05586 2/20 0.54
▸ GRIN2A Q12879 2/20 0.54
▸ GRIN2B Q13224 2/20 0.54
▸ GRIN2C Q14957 2/20 0.54
▸ GRIN3A Q8TCU5 2/20 0.54
▸ ALDH1A1 P00352 3/20 0.53
▸ HPGD P15428 3/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ MEN1 O00255 1/20 0.53

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
SCHEMBL29586144 0.96 PARP1 (0.58) PARP1SMN1; SMN2TP53LMNACA1
SCHEMBL14543826 0.92 PARP1 (0.59) PARP1SMN1; SMN2TP53LMNACA1
SCHEMBL4231006 0.90 GAA (0.67) PARP1SMN1; SMN2TP53LMNACA1
SCHEMBL3609835 0.89 GRIN2D (0.54) PARP1SMN1; SMN2TP53LMNACA9
SCHEMBL6009587 0.85 PARP1 (0.65) PARP1SMN1; SMN2TP53LMNADAO
SCHEMBL31167250 0.85 PARP1 (0.65) PARP1SMN1; SMN2TP53LMNADAO
SCHEMBL28405063 0.84 ABCG2 (0.56) PARP1SMN1; SMN2TP53LMNACA9
SCHEMBL276018 0.83 LMNA (0.56) PARP1SMN1; SMN2TP53LMNACA1
SCHEMBL29354683 0.83 LMNA (0.56) PARP1SMN1; SMN2TP53LMNACA1
SCHEMBL29586622 0.83 LMNA (0.56) PARP1SMN1; SMN2TP53LMNACA1

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-7205311-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED 2007-04-17 — — US disclosed
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