SCHEMBL8847296

SCHEMBL8847296

O=S(=O)(O)CCc1cncc(CCS(=O)(=O)O)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ PTGS1 P23219 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SLC6A6 P31641 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ APLNR P35414 1/20 0.31
▸ APP P05067 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL28040448 0.91 CA2 (0.34) TBXAS1POLBRECQLESR2NOS1
SCHEMBL769818 0.76 CHRNA7 (0.53) TBXAS1
SCHEMBL28040551 0.75 CA2 (0.34) TBXAS1POLBRECQLESR2NOS1
SCHEMBL8847343 0.75 — —
SCHEMBL14399649 0.74 CA2 (0.39) PTGS1PDE4ANPC1
SCHEMBL819155 0.74 KMT2A (0.53) LMNANPC1KMT2A
SCHEMBL17508105 0.72 KMT2A (0.51) LMNANPC1KMT2A
SCHEMBL8847199 0.72 PTGS1 (0.31) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL9343856 0.72 KMT2A (0.51) LMNANPC1KMT2A
SCHEMBL8847164 0.72 PTGS1 (0.31) PTGS1PDE4ALMNASLC6A6CYP2C19

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-0603557-B1 Catalyst compositions and catalytic processes PHILLIPS PETROLEUM CO (US) 1997-07-30 — — EP disclosed
US-5461126-A Process of polymerizing olefins using organonickel catalyst compositions PHILLIPS PETROLEUM COMPANY (US) 1995-10-24 — — US disclosed
US-5332708-A Ethylene polymerization catalyst, organonickel compound and a heterocyclic nitrogen compound PHILLIPS PETROLEUM COMPANY (US) 1994-07-26 — — US disclosed
EP-0603557-A1 Catalyst compositions and catalytic processes PHILLIPS PETROLEUM COMPANY (US) 1994-06-29 — — EP disclosed
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