SCHEMBL7825081

SCHEMBL7825081

O=C(O)c1sccc1SCc1cccc(C(F)(F)F)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 5/20 0.69
▸ MAPT P10636 5/20 0.69
▸ NPSR1 Q6W5P4 4/20 0.69
▸ HPGD P15428 3/20 0.69
▸ ALDH1A1 P00352 3/20 0.69
▸ HTT P42858 2/20 0.69
▸ LMNA P02545 1/20 0.69
▸ PTPRC P08575 5/20 0.69
▸ PTPRG P23470 5/20 0.69
▸ CYP1A2 P05177 1/20 0.68
▸ CYP3A4 P08684 1/20 0.68
▸ ALPG P10696 1/20 0.68
▸ CYP2C9 P11712 1/20 0.68
▸ CYP2C19 P33261 1/20 0.68
▸ GAA P10253 2/20 0.66
▸ KMT2A Q03164 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ GFER P55789 2/20 0.49

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
SCHEMBL11823732 0.79 GFER (0.54) L3MBTL1MAPTNPSR1HPGDALDH1A1
SCHEMBL11820534 0.79 EPHX1 (0.51) L3MBTL1MAPTNPSR1HPGDALDH1A1
SCHEMBL7823506 0.76 L3MBTL1 (0.77) L3MBTL1ALDH1A1PTPRCGAAKMT2A
SCHEMBL11817250 0.76 NR4A2 (0.52) L3MBTL1MAPTNPSR1HPGDALDH1A1
SCHEMBL4024131 0.75 L3MBTL1 (0.68) L3MBTL1MAPTNPSR1HPGDALDH1A1
SCHEMBL7509205 0.75 PTPRG (1.00) MAPTPTPRCPTPRGKMT2A
SCHEMBL11825039 0.73 DAO (0.53) MAPTALDH1A1GAAGFERDAO
SCHEMBL7830138 0.72 PTPRG (1.00) MAPTALDH1A1HTTPTPRCPTPRG
SCHEMBL4021401 0.72 PTPRC (0.75) L3MBTL1MAPTNPSR1HPGDALDH1A1
SCHEMBL14049923 0.72 KDM4E (0.47) L3MBTL1MAPTNPSR1HPGDALDH1A1

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
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 — — EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 — — WO disclosed
Send feedback