SCHEMBL7112124

SCHEMBL7112124

O=S(=O)(O)c1ccc(-c2ccc(C=Cc3ccc(-c4ccc(S(=O)(=O)O)cc4)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.59
▸ LMNA P02545 1/20 0.50
▸ TSHR P16473 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ NT5E P21589 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CA12 O43570 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ HDAC2 Q92769 4/20 0.40
▸ HDAC3 O15379 3/20 0.40
▸ HDAC4 P56524 3/20 0.40
▸ HDAC1 Q13547 3/20 0.40
▸ HDAC7 Q8WUI4 3/20 0.40
▸ HDAC10 Q969S8 3/20 0.40
▸ HDAC11 Q96DB2 3/20 0.40
▸ HDAC8 Q9BY41 3/20 0.40
▸ HDAC6 Q9UBN7 3/20 0.40

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
SCHEMBL7112122 1.00 TDP1 (0.59) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL6881757 1.00 TDP1 (0.59) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL6881761 1.00 TDP1 (0.59) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL23387512 0.98 TDP1 (0.57) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL14514188 0.93 TDP1 (0.67) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL10886972 0.93 TDP1 (0.67) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL11391935 0.93 TDP1 (0.67) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL11391960 0.93 TDP1 (0.67) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL3171676 0.85 LMNA (0.65) TDP1LMNATSHRALDH1A1NT5E
SCHEMBL29990536 0.85 LMNA (0.65) TDP1LMNATSHRALDH1A1NT5E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0968255-B1 PIGMENT FLAKES MERCK PATENT GMBH (DE) 2003-05-28 — — EP disclosed
US-6552102-B2 Pigment flakes comprise at least one dye that is chemically bound to the polymer MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2003-04-22 — — US disclosed
US-20030017280-A1 Pigment flakes POETSCH EIKE (DE) 2003-01-23 — — US disclosed
EP-0968255-A1 PIGMENT FLAKES MERCK PATENT GmbH (DE) 2000-01-05 — — EP disclosed
WO-1998042799-A1 PIGMENT FLAKES MERCK PATENT GMBH (DE) 1998-10-01 — — WO disclosed
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