SCHEMBL10936152

SCHEMBL10936152

CC(C)S(=O)(=O)c1ccc(C(=O)Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
HTT P42858 2/20 0.39
POLB P06746 2/20 0.39
LMNA P02545 1/20 0.39
NOD2 Q9HC29 1/20 0.39
TAS2R14 Q9NYV8 1/20 0.38
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
CXCR2 P25025 1/20 0.35

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
SCHEMBL14443234 0.82 CA1 (0.51) ALDH1A1LMNACA2CA1HPGD
SCHEMBL1020457 0.82 CA2 (0.55) ALDH1A1TAS2R14CA2CA1RAB9A
SCHEMBL16473924 0.80 KDM4E (0.46) ALDH1A1TAS2R14CA2CA1HPGD
SCHEMBL2027640 0.80 CA2 (0.59) ALDH1A1POLBCA2CA1KMT2A
SCHEMBL10060475 0.80 ALDH1A1 (0.40) ALDH1A1POLBCA2CA1MAPT
SCHEMBL16225258 0.77 SMN1; SMN2 (0.47) ALDH1A1HTTLMNATAS2R14CA2
SCHEMBL10933934 0.77 ALDH1A1 (0.48) ALDH1A1TAS2R14HPGD
SCHEMBL599583 0.77 ENPP2 (0.54)
SCHEMBL724893 0.76 ALDH1A1 (0.50) ALDH1A1POLBLMNAHPGDKMT2A
SCHEMBL14464916 0.76 ALDH1A1 (0.38) ALDH1A1TAS2R14CA2CA1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0041711-B1 6-CHLORO- OR 6-BROMO-1,2-DIHYDRO-3H-PYRROLO(1,2-A)-PYRROLE-1-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF, PROCESS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYNTEX (U.S.A.) INC. (US) 1985-04-17 EP disclosed
US-4344943-A ANALGESICS, ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1982-08-17 US disclosed
EP-0041711-A1 6-Chloro- or 6-bromo-1,2-dihydro-3H-pyrrolo(1,2-a)-pyrrole-1-carboxylic acids and derivatives thereof, process for their production and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1981-12-16 EP disclosed