SCHEMBL26104382

SCHEMBL26104382

NS(=O)(=O)c1ccccc1CC(=O)c1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 8/20 0.43
▸ CA2 P00918 8/20 0.43
▸ CA9 Q16790 5/20 0.43
▸ CA12 O43570 3/20 0.43
▸ STS P08842 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ LIG1 P18858 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ALPI P09923 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALPG P10696 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ CASP3 P42574 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ BLM P54132 1/20 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
SCHEMBL6026669 0.89 CA1 (0.54) CA1CA2CA9CA12STS
SCHEMBL6024976 0.86 CA1 (0.48) CA1CA2CA9CA12STS
SCHEMBL8898937 0.80 AKR1B1 (0.59) NPC1RAB9ALIG1PTPN1ALDH1A1
SCHEMBL14878603 0.77 RAB9A (0.46) NPC1RAB9APTPN1ALDH1A1KDM4E
SCHEMBL10362231 0.76 AKR1B1 (0.59) CA1CA2CA9CA12TDP1
SCHEMBL4749786 0.76 CA1 (0.49) CA1CA2CA9CA12GAA
SCHEMBL2500403 0.75 MMP2 (0.53) CA1CA2CA9CA12PTPN1
SCHEMBL6171405 0.74 KMT2A (0.50) RAB9AALDH1A1POLBGAATDP1
SCHEMBL18322483 0.72 CA1 (0.45) CA1CA2CA9CA12MAPK1
SCHEMBL6026006 0.72 MAPK1 (0.46) CA1CA2CA9CA12STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023074936-A1 BIFUNCTIONAL COMPOUND USING UBR BOX DOMAIN-BINDING LIGAND 주식회사 오토텍바이오 2023-05-04 — — WO claimed
WO-2023074936-A1 BIFUNCTIONAL COMPOUND USING UBR BOX DOMAIN-BINDING LIGAND 주식회사 오토텍바이오 2023-05-04 — — WO disclosed
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