SCHEMBL11478388

SCHEMBL11478388

O=C(O)c1cnc(=O)n2c1sc1cc(O)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 2/20 0.39
▸ TNKS O95271 1/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ PARP15 Q460N3 1/20 0.39
▸ PARP14 Q460N5 1/20 0.39
▸ TNKS2 Q9H2K2 1/20 0.39
▸ PARP11 Q9NR21 1/20 0.39
▸ PARP2 Q9UGN5 1/20 0.39
▸ PARP4 Q9UKK3 1/20 0.39
▸ PARP3 Q9Y6F1 1/20 0.39
▸ HCAR2 Q8TDS4 3/20 0.37
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA7 P43166 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ CA14 Q9ULX7 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ PTGS2 P35354 1/20 0.35

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
SCHEMBL11347014 0.86 SMN1; SMN2 (0.39) PARP15TNKS2PARP2CA1CA2
SCHEMBL11359826 0.86 PARP10 (0.47) PARP10TNKSPARP1PARP15PARP14
SCHEMBL11356753 0.82 PDE1B (0.44) CA12CA1CA2CA7CA9
SCHEMBL11346661 0.81 PDE11A (0.53) ALDH1A1TSHRKDM4EMAPTKMT2A
SCHEMBL11352930 0.77 LCK (0.36) TSHRKDM4EMAPTKMT2AMEN1
SCHEMBL11475697 0.75 ALDH1A1 (0.39) ALDH1A1KDM4EKMT2AMEN1CYP2C9
SCHEMBL11422603 0.74 ALDH1A1 (0.40) ALDH1A1MAPTKMT2APKMMEN1
SCHEMBL11473698 0.69 TP53 (0.52) CA12CA2CA7CA9CA14
SCHEMBL11418009 0.68 KDM4E (0.36) ALDH1A1TSHRKDM4EMAPTKMT2A
SCHEMBL11347017 0.68 PARP15 (0.36) PARP15TNKS2PARP2MAPTKMT2A

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-4232024-A ANTIALLERGENS BOEHRINGER MANNHEIM GMBH (DE) 1980-11-04 — — US disclosed
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