SCHEMBL15935985

SCHEMBL15935985

NS(=O)(=O)Cc1cc([C@@H](O)CBr)ccc1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACP1 P24666 1/20 0.40
▸ PTPN12 Q05209 1/20 0.40
▸ PTPN13 Q12923 1/20 0.40
▸ SSU72 Q9NP77 1/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ FOLH1 Q04609 1/20 0.38
▸ CCR5 P51681 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA5A P35218 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ CFD P00746 1/20 0.38
▸ F11 P03951 1/20 0.38
▸ TPSB2 P20231 1/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ P2RX4 Q99571 1/20 0.37
▸ USP28 Q96RU2 1/20 0.37
▸ USP25 Q9UHP3 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
SCHEMBL7086395 0.87 KMT2A (0.38) ACP1PTPN12PTPN13SSU72STAT3
SCHEMBL1311395 0.83 ELANE (0.47) LMNAHTTCCR5USP28USP25
SCHEMBL27529170 0.80 EGFR (0.43) FOLH1RAB9A
SCHEMBL27529171 0.80 EGFR (0.43) FOLH1RAB9A
SCHEMBL5707160 0.79 PRMT5 (0.42) FOLH1CCR5KMT2ARAB9A
SCHEMBL30286115 0.79 PRMT5 (0.42) FOLH1CCR5KMT2ARAB9A
SCHEMBL1311951 0.79 PRMT5 (0.42) FOLH1CCR5KMT2ARAB9A
SCHEMBL2671449 0.79 PRMT5 (0.42) FOLH1CCR5KMT2ARAB9A
SCHEMBL7693480 0.78 ELANE (0.35) STAT3LMNAHTTCCR5CA1
SCHEMBL5080739 0.78 ELANE (0.35) STAT3LMNAHTTCCR5CA1

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
EP-2764866-A1 Inhibitors of nedd8-activating enzyme IP Gesellschaft für Management mbH (DE) 2014-08-13 — — EP disclosed
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