SCHEMBL6980269

SCHEMBL6980269

Cc1ccc([C@@H](CO)OS(=O)(=O)c2ccccc2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 4/20 0.38
▸ GAA P10253 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ ESR1 P03372 2/20 0.38
▸ ESR2 Q92731 2/20 0.38
▸ HCRTR2 O43614 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ALDH1A1 P00352 5/20 0.35
▸ MAPT P10636 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ F2 P00734 2/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ GSR P00390 1/20 0.35
▸ FFAR1 O14842 1/20 0.33
▸ NPC1 O15118 1/20 0.33

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
SCHEMBL6986846 0.91 GSR (0.43) POLBKMT2AGAAMEN1ESR1
SCHEMBL6980162 0.85 KMT2A (0.39) POLBKMT2AGAAMEN1ESR1
SCHEMBL17164172 0.79 GSR (0.46) ALDH1A1HTTGSRLMNASMN1; SMN2
SCHEMBL6982213 0.79 GSR (0.46) ALDH1A1HTTGSRLMNASMN1; SMN2
SCHEMBL6975734 0.76 KMT2A (0.37) POLBKMT2AGAAMEN1ESR1
SCHEMBL10452676 0.75 CYP3A4 (0.47) POLBKMT2AGAAMEN1ESR1
SCHEMBL4732118 0.73 ENPP2 (0.46) KMT2AGAAMEN1ALDH1A1MAPT
SCHEMBL14778954 0.71 MEN1 (0.44) POLBKMT2AGAAMEN1ESR1
SCHEMBL4936612 0.71 MEN1 (0.44) POLBKMT2AGAAMEN1ESR1
SCHEMBL4731826 0.70 LMNA (0.51) POLBKMT2AGAAMEN1ESR1

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-0817772-B1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER (US) 2003-01-29 — — EP disclosed
US-6110947-A AN ANALGESIC AGENT FOR TREATING STROKE, ABDOMINAL PAIN; AS ANTIINFLAMMATORY, DIURETIC, ANESTHETIC OR NEUROPROTECTIVE AGENTS PFIZER INC. (US) 2000-08-29 — — US disclosed
US-5952369-A ANALGESIC, TREATMENT FOR STROKE OR ABDOMINAL PAIN ASSOCIATED WITH FUNCTIONAL BOWEL DISEASE PFIZER INC (US) 1999-09-14 — — US disclosed
WO-1996030339-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1996-10-03 — — WO disclosed
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