SCHEMBL13665160

SCHEMBL13665160

O=C(C(CCn1ccnc1NO)NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)N1CCc2ccccc2C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR10 P46092 7/20 0.44
▸ HDAC8 Q9BY41 1/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ SPR P35270 1/20 0.39
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ TAS1R2 Q8TE23 1/20 0.38
▸ F10 P00742 1/20 0.38
▸ CCKBR P32239 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ PLA2G1B P04054 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL13665881 0.95 CCR10 (0.52) CCR10HDAC8KMT2ANPSR1MEN1
SCHEMBL13665628 0.94 CCR10 (0.42) CCR10KMT2ANPSR1MEN1USP2
SCHEMBL13665267 0.87 CCR10 (0.58) CCR10
SCHEMBL1312078 0.87 CCR10 (0.55) CCR10HDAC8KMT2ANPSR1MEN1
SCHEMBL1074363 0.86 CCR10 (0.54) CCR10HDAC8KMT2ANPSR1MEN1
SCHEMBL1076161 0.84 CCR10 (0.51) CCR10KMT2ANPSR1MEN1USP2
SCHEMBL13665174 0.83 CCR10 (0.62) CCR10
SCHEMBL1075035 0.82 CCR10 (0.56) CCR10HDAC8KMT2ANPSR1MEN1
SCHEMBL13665867 0.81 CCR10 (0.40) CCR10KMT2ANPSR1MEN1USP2
SCHEMBL1311486 0.80 CCR10 (0.55) CCR10KMT2ANPSR1MEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009126675-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-10-15 — — WO disclosed
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