SCHEMBL8445289

SCHEMBL8445289

O=C(O)c1ccccc1Sc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.68
▸ L3MBTL1 Q9Y468 1/20 0.68
▸ MAPT P10636 8/20 0.58
▸ LMNA P02545 2/20 0.58
▸ MAPK1 P28482 5/20 0.57
▸ KDM4E B2RXH2 4/20 0.57
▸ NSD2 O96028 1/20 0.57
▸ MEN1 O00255 4/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ POLB P06746 2/20 0.53
▸ THRB P10828 2/20 0.53
▸ RECQL P46063 1/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MMP14 P50281 1/20 0.49
▸ KEAP1 Q14145 3/20 0.49
▸ NFE2L2 Q16236 1/20 0.49
▸ TTR P02766 1/20 0.48
▸ PKM P14618 3/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45

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
SCHEMBL2639922 0.97 ALDH1A1 (0.62) ALDH1A1L3MBTL1MAPTLMNAMAPK1
SCHEMBL11604598 0.95 MAPT (0.63) ALDH1A1L3MBTL1MAPTLMNAMAPK1
SCHEMBL6825619 0.90 MAPT (0.57) ALDH1A1L3MBTL1MAPTLMNAMAPK1
SCHEMBL11421896 0.85 MAPT (0.69) ALDH1A1L3MBTL1MAPTLMNAMAPK1
SCHEMBL14621260 0.82 MAPT (0.58) ALDH1A1L3MBTL1MAPTMAPK1KDM4E
SCHEMBL5186500 0.82 POLB (0.57) ALDH1A1L3MBTL1MAPTLMNAMAPK1
SCHEMBL461660 0.81 ALDH1A1 (1.00) ALDH1A1L3MBTL1MAPTLMNAMAPK1
Anthraquinone SCHEMBL8941397 0.81 ALDH1A1 (1.00) ALDH1A1L3MBTL1MAPTLMNAMAPK1
Hydrochloric Acid SCHEMBL8675457 0.80 ALDH1A1 (0.96) ALDH1A1L3MBTL1MAPTLMNAMAPK1
SCHEMBL1482567 0.79 POLB (0.74) ALDH1A1L3MBTL1MAPTKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948570-A1 METHOD FOR PREPARING LIGHT-ABSORBING POLYMERIC COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 1999-10-13 — — EP disclosed
WO-1998023690-A9 METHOD FOR PREPARING LIGHT-ABSORBING POLYMERIC COMPOSITIONS — 1998-09-17 — — WO disclosed
WO-1998023690-A1 METHOD FOR PREPARING LIGHT-ABSORBING POLYMERIC COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 1998-06-04 — — WO disclosed
EP-0040139-A2 Polyester polymers comprising copolymerised moieties derived from anthraquinone dyes EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1981-11-18 — — EP disclosed
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