SCHEMBL9340238

SCHEMBL9340238

CCCCC(CC)COC(=O)CCS(=O)(=O)O

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.71
▸ TSHR P16473 3/20 0.71
▸ TDP1 Q9NUW8 2/20 0.71
▸ ATM Q13315 1/20 0.71
▸ RECQL P46063 1/20 0.63
▸ ALDH1A1 P00352 6/20 0.48
▸ CA2 P00918 3/20 0.48
▸ LMNA P02545 4/20 0.44
▸ MAPK1 P28482 3/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ PRSS1 P07477 1/20 0.43
▸ PRSS2 P07478 1/20 0.43
▸ PRSS3 P35030 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ DUSP3 P51452 1/20 0.39

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
SCHEMBL9889024 0.88 CYP3A4 (0.71) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL44320 0.85 CYP3A4 (0.89) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL6014128 0.84 CYP3A4 (0.86) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL1336595 0.84 CYP3A4 (0.86) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL31338802 0.84 CYP3A4 (0.86) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL27423 0.84 CYP3A4 (1.00) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL3849332 0.84 CYP3A4 (0.93) CYP3A4TSHRTDP1ATMRECQL
SCHEMBL247018 0.84 CYP3A4 (0.93) CYP3A4TSHRTDP1ATMRECQL
Ammonia Solution, Strong SCHEMBL16192512 0.84 CYP3A4 (0.86) CYP3A4TSHRTDP1ATMRECQL
Magnesium SCHEMBL31454400 0.84 CYP3A4 (0.86) CYP3A4TSHRTDP1ATMRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0197987-B2 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE ZAMBON SPA (IT) 1994-06-29 — — EP claimed
WO-1988007381-A1 BLEND POLYMERS LUISI PIER LUIGI (CH) 1988-10-06 — — WO claimed
EP-0197987-A1 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE. LUISI PIER LUIGI (CH) 1986-10-22 — — EP claimed
WO-1986002264-A1 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE LUISI PIER LUIGI (CH) 1986-04-24 — — WO claimed
CN-103797048-B Process for preparing poly (hydroxymethyl) functional siloxanes and silica gels WACKER CHEMIE AG (DE) 2015-11-25 — — CN disclosed
CN-103797048-A Process for preparing poly (hydroxymethyl) functional siloxanes and silica gels WACKER CHEMIE AG 2014-05-14 — — CN disclosed
WO-2013039252-A1 HYDROPHILIC MEMBER AND FORMING METHOD OF THE SAME FUJIFILM CORPORATION (JP) 2013-03-21 — — WO disclosed
EP-0197987-B2 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE ZAMBON SPA (IT) 1994-06-29 — — EP disclosed
EP-0197987-B1 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE ZAMBON SPA (IT) 1989-09-20 — — EP disclosed
EP-0197987-A1 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE. LUISI PIER LUIGI (CH) 1986-10-22 — — EP disclosed
WO-1986002264-A1 PROCESS FOR PREPARING A SOLUTION OF INVERTED MICELLAE LUISI PIER LUIGI (CH) 1986-04-24 — — WO disclosed
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