SCHEMBL6975734

SCHEMBL6975734

COCOc1cccc([C@@H](CO)OS(=O)(=O)c2ccccc2C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.37
▸ MEN1 O00255 5/20 0.37
▸ ESR1 P03372 2/20 0.37
▸ ESR2 Q92731 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ FFAR1 O14842 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ PTPN1 P18031 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ GAA P10253 2/20 0.34
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ PRKG1 Q13976 1/20 0.31
▸ TRPV4 Q9HBA0 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL6980162 0.82 KMT2A (0.39) KMT2AMEN1ESR1ESR2ATM
SCHEMBL6986846 0.80 GSR (0.43) KMT2AMEN1ESR1ESR2ATM
SCHEMBL6980269 0.76 POLB (0.40) KMT2AMEN1ESR1ESR2ATM
SCHEMBL6975924 0.70 AOC3 (0.48) FFAR1TSHRMAPK1L3MBTL1
SCHEMBL8590346 0.70 AOC3 (0.48) FFAR1TSHRMAPK1L3MBTL1
SCHEMBL6978184 0.70 AOC3 (0.48) FFAR1TSHRMAPK1L3MBTL1
SCHEMBL4753419 0.68 TSHR (0.41) KMT2AMEN1FFAR1TSHRMAPK1
SCHEMBL3909351 0.66 AOC3 (0.43) KMT2AMEN1FFAR1TSHRMAPK1
SCHEMBL3151292 0.66 KDM4E (0.55) KMT2AMEN1FFAR1CYP1A2CYP2C9
SCHEMBL6916199 0.66 KMT2A (0.42) KMT2AMEN1ESR1ESR2ATM

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
Send feedback