SCHEMBL28410024

SCHEMBL28410024

COc1ccc(Cc2nccnc2S(N)(=O)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.47
▸ PDE3A Q14432 2/20 0.47
▸ PDE10A Q9Y233 2/20 0.47
▸ KDR P35968 1/20 0.45
▸ CA1 P00915 6/20 0.43
▸ CA2 P00918 6/20 0.43
▸ CA9 Q16790 6/20 0.43
▸ CA12 O43570 4/20 0.43
▸ CA5A P35218 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ CA4 P22748 2/20 0.43
▸ CA7 P43166 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ ATM Q13315 1/20 0.41

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
SCHEMBL28413114 0.83 KDR (0.46) PDE3BPDE3APDE10AKDRCA1
SCHEMBL29056086 0.80 NPC1 (0.45) KDRCA1CA2CA9CA12
SCHEMBL29250116 0.80 TP53 (0.46) PDE3BPDE3APDE10AALDH1A1CYP2D6
SCHEMBL31556358 0.79 PDE3B (0.47) PDE3BPDE3APDE10AKDRCA1
Ammonia Solution, Strong SCHEMBL29153964 0.79 PDE3B (0.58) PDE3BPDE3APDE10AKDRCA1
SCHEMBL29999550 0.76 ALDH1A1 (0.54) PDE3BPDE3APDE10APOLBALDH1A1
SCHEMBL26131691 0.76 ALDH1A1 (0.54) PDE3BPDE3APDE10APOLBALDH1A1
SCHEMBL20609814 0.76 NPSR1 (0.48) PDE3BPDE3APDE10AKDRCA1
SCHEMBL29162293 0.75 KDR (0.49) PDE3BPDE3APDE10AKDRCA1
SCHEMBL28383956 0.72 ALDH1A1 (0.46) KDRCA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111132974-B Sulfonamide carboxamide compounds 英夫拉索姆有限公司 2023-11-21 — — CN disclosed
CN-111132974-A Novel sulfonamide carboxamide compounds 英夫拉索姆有限公司 2020-05-08 — — CN disclosed
CN-110914256-A Novel sulfonamide carboxamide compounds 英夫拉索姆有限公司 2020-03-24 — — CN disclosed
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