SCHEMBL2011504

SCHEMBL2011504

O=C(NCc1ccccc1)C1CCC(c2ccccc2)N(S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
KMT2A Q03164 4/20 0.53
RAB9A P51151 1/20 0.53
USP2 O75604 1/20 0.51
HPGD P15428 1/20 0.51
FKBP1A P62942 1/20 0.51
MEN1 O00255 3/20 0.49
PKM P14618 1/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MAPT P10636 1/20 0.47

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
SCHEMBL12628159 1.00 ALDH1A1 (0.54) ALDH1A1KMT2ARAB9AUSP2HPGD
SCHEMBL2011582 0.92 ALDH1A1 (0.60) ALDH1A1KMT2AFKBP1AMEN1
SCHEMBL2012438 0.92 KMT2A (0.53) ALDH1A1KMT2AFKBP1AMEN1PKM
SCHEMBL2012792 0.92 ALDH1A1 (0.55) ALDH1A1KMT2ARAB9AMEN1GAA
SCHEMBL2017637 0.92 ALDH1A1 (0.66) ALDH1A1KMT2ARAB9AMEN1PKM
SCHEMBL12629084 0.92 ALDH1A1 (0.66) ALDH1A1KMT2ARAB9AMEN1PKM
SCHEMBL12629080 0.92 ALDH1A1 (0.60) ALDH1A1KMT2AFKBP1AMEN1
SCHEMBL12628174 0.92 KMT2A (0.58) ALDH1A1KMT2ARAB9AMEN1MAPT
SCHEMBL2013800 0.92 ALDH1A1 (0.52) ALDH1A1KMT2ARAB9AUSP2HPGD
SCHEMBL12628292 0.92 KMT2A (0.55) ALDH1A1KMT2AMEN1PKM

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
WO-2011073269-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO claimed
WO-2011073269-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 WO disclosed