SCHEMBL9511926

SCHEMBL9511926

O=C(O)CN(CCCCCNS(=O)(=O)c1ccc(Cl)cc1)Cc1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 1/20 0.55
SIGMAR1 Q99720 1/20 0.55
TBXA2R P21731 6/20 0.53
ALDH1A1 P00352 3/20 0.50
TP53 P04637 1/20 0.50
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
FABP4 P15090 2/20 0.46
TBXAS1 P24557 7/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL9511890 0.82 TMEM97 (0.61) TMEM97SIGMAR1TBXA2RALDH1A1TP53
SCHEMBL566005 0.81 TSHR (0.61) TMEM97SIGMAR1TBXA2RALDH1A1TP53
SCHEMBL9870095 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9872413 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9870233 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9869922 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9879916 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9871736 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9872542 0.77 TBXA2R (0.75) TBXA2RALDH1A1TP53GAAFABP4
SCHEMBL9577200 0.76 ALDH1A1 (0.68) TMEM97SIGMAR1ALDH1A1TP53GAA

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-0353448-B1 Sulfon amides, process for their preparation and pharmaceutical preparations containing them BOEHRINGER MANNHEIM GMBH (DE) 1993-10-27 EP disclosed
US-4981873-A ANTICOAGULANTS BOEHRINGER MANNHEIM GMBH (DE) 1991-01-01 US disclosed