SCHEMBL6582653

SCHEMBL6582653

NS(=O)(=O)c1ccc(CCCl)cc1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 19/20 0.67
▸ CA1 P00915 12/20 0.67
▸ CA12 O43570 9/20 0.67
▸ CA9 Q16790 9/20 0.67
▸ CA4 P22748 7/20 0.67
▸ CA6 P23280 4/20 0.67
▸ CA5A P35218 4/20 0.67
▸ CA7 P43166 4/20 0.67
▸ CA14 Q9ULX7 4/20 0.67
▸ CA5B Q9Y2D0 4/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ MAPT P10636 1/20 0.57
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53

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
SCHEMBL8506132 0.88 CA2 (0.67) CA2CA1CA12CA9CA4
SCHEMBL10431754 0.86 CA2 (0.68) CA2CA1CA12CA9CA4
SCHEMBL587389 0.82 HTR6 (0.53) CA2CA1CA12CA9CA4
SCHEMBL2304051 0.82 CA2 (0.64) CA2CA1CA12CA9CA4
SCHEMBL27609957 0.80 ALDH1A1 (0.46) CA2CA1CA12CA9CA4
SCHEMBL6063750 0.80 CA2 (0.61) CA2CA1CA12CA9CA4
SCHEMBL142107 0.80 CA2 (1.00) CA2CA1CA12CA9CA4
SCHEMBL1804221 0.80 CA2 (0.69) CA2CA1CA12CA9CA4
SCHEMBL11730795 0.80 CA2 (0.69) CA2CA1CA12CA9CA4
SCHEMBL6581495 0.78 ENPP2 (0.46) CA2CA1CA12CA9CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1112265-B1 2-ARYLALKYLTHIO -IMIDAZOLES, 2-ARYLALKENYL -THIO -IMIDAZOLES AND 2-ARYLALKINYL -THIO -IMIDAZOLES AS ANTI -INFLAMMATORY SUBSTANCES AND SUBSTANCES INHIBITING THE RELEASE OF CYTOKINE MERCKLE GMBH (DE) 2004-01-14 — — EP disclosed
US-6432988-B1 RHEUMATIC DISEASES, (OSTEO)ARTHRITIS, CACHEXIA, INFLAMMATORY BOWEL DISEASE, TOXIC SHOCK SYNDROME, SEPSIS, CROHN*S DISEASE, PSORIASIS AND GOUT TREATMENT MERCKLE GMBH (DE) 2002-08-13 — — US disclosed
EP-1112265-A1 2-ARYLALKYLTHIO -IMIDAZOLES, 2-ARYLALKENYL -THIO -IMIDAZOLES AND 2-ARYLALKINYL -THIO -IMIDAZOLES AS ANTI -INFLAMMATORY SUBSTANCES AND SUBSTANCES INHIBITING THE RELEASE OF CYTOKINE MERCKLE GMBH (DE) 2001-07-04 — — EP disclosed
WO-2000017192-A1 2-ARYLALKYLTHIO -IMIDAZOLES, 2-ARYLALKENYL -THIO -IMIDAZOLES AND 2-ARYLALKINYL -THIO -IMIDAZOLES AS ANTI -INFLAMMATORY SUBSTANCES AND SUBSTANCES INHIBITING THE RELEASE OF CYTOKINE MERCKLE GMBH (DE) 2000-03-30 — — WO disclosed
EP-0505376-B1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LTD (GB) 1994-12-07 — — EP disclosed
US-5340831-A Muscarinic receptor antagonists PFIZER INC. (US) 1994-08-23 — — US disclosed
EP-0233051-B1 ANTIARRHYTHMIC AGENTS Pfizer Limited (GB) 1993-09-15 — — EP disclosed
EP-0505376-A1 MUSCARINIC RECEPTOR ANTAGONISTS. PFIZER LTD (GB) 1992-09-30 — — EP disclosed
WO-1991009013-A1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 1991-06-27 — — WO disclosed
US-4806536-A Piperazinyl-substituted pyridine and imidazole anti-arrhythmic agents PFIZER, INC. (US) 1989-02-21 — — US disclosed
EP-0233051-A2 Antiarrhythmic Agents Pfizer Limited (GB) 1987-08-19 — — EP disclosed
US-4017631-A MICROBIOCIDES JANSSEN PHARMACEUTICA N.V. (BE) 1977-04-12 — — US disclosed
US-3991202-A ANTIMICROBIALS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-09 — — US disclosed
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