SCHEMBL7438589

SCHEMBL7438589

O=Cc1cccc(OS(=O)(=O)c2ccccc2Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 11/20 0.44
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ HPGD P15428 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SRC P12931 1/20 0.42
▸ NFE2L2 Q16236 1/20 0.40
▸ PRSS2 P07478 3/20 0.40
▸ F10 P00742 2/20 0.39
▸ CTRC Q99895 4/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6554508 0.80 F2 (0.49) F2KMT2APRSS2F10CTRC
SCHEMBL30217935 0.79 TDP1 (0.52) F2KMT2ANPC1RAB9APRSS2
SCHEMBL196710 0.79 TDP1 (0.52) F2KMT2ANPC1RAB9APRSS2
SCHEMBL6553022 0.73 F2 (0.57) F2MAOAMAOBPRSS2F10
SCHEMBL11846316 0.73 F2 (0.44) F2KMT2APRSS2F10CTRC
SCHEMBL3660148 0.73 SRC (0.50) MAOAMAOBNPC1RAB9AMAPT
SCHEMBL3022240 0.73 SRC (0.54) MAOAMAOBHPGDKMT2ANPC1
SCHEMBL32665231 0.73 SRC (0.50) MAOAMAOBHPGDKMT2ANPC1
SCHEMBL7447142 0.72 F2 (0.46) F2PRSS2F10CTRC
SCHEMBL5896124 0.72 MAPT (0.49) MAOAMAOBHPGDKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0859607-B1 GUANIDINO PROTEASE INHIBITORS DIMENSIONAL PHARM INC (US) 2002-12-18 — — EP disclosed
EP-0859607-A4 GUANIDINO PROTEASE INHIBITORS DIMENSIONAL PHARM INC (US) 1999-05-06 — — EP disclosed
EP-0859607-A1 GUANIDINO PROTEASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1998-08-26 — — EP disclosed
US-5792769-A POTENT ANTICOAGULANT, ANTIINFLAMMATORY AGENT; TREATMENT/PROPHYLAXIS OF RESPIRATORY SYSTEM DISORDERS, VASCULAR SYSTEM DISORDERS, ANTITUMOR AGENTS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1998-08-11 — — US disclosed
WO-1997011693-A1 GUANIDINO PROTEASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1997-04-03 — — WO disclosed
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