SCHEMBL14878433

SCHEMBL14878433

NC(=O)[C@H]1CN(S(=O)(=O)CCN2CCCCC2)CCN1S(=O)(=O)c1cc(F)c(Oc2ccc(Cl)cc2)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 1/20 0.36
MMP8 P22894 2/20 0.35
MMP3 P08254 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
SOS1 Q07889 1/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
HRH3 Q9Y5N1 6/20 0.34
GHSR Q92847 1/20 0.34
AHCY P23526 1/20 0.34

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
SCHEMBL14878440 0.93 ALDH1A1 (0.37) ALDH1A1GAASMN1; SMN2KMT2AMMP8
SCHEMBL12905475 0.92 KMT2A (0.35) ALDH1A1HTTSMN1; SMN2KMT2AMAPT
SCHEMBL14959560 0.92 ALDH1A1 (0.36) ALDH1A1GAAKMT2AMAPTMMP8
SCHEMBL14878421 0.92 GAA (0.36) ALDH1A1GAASMN1; SMN2KMT2AMAPT
SCHEMBL779081 0.90 MMP1 (0.46) MMP8MMP3MMP2MMP9
SCHEMBL14878422 0.89 POLB (0.44) ALDH1A1GAAHTTSMN1; SMN2KMT2A
SCHEMBL14878434 0.86 MMP1 (0.36) ALDH1A1KMT2AMMP8MMP3MEN1
SCHEMBL14878475 0.85 MMP1 (0.37) KMT2AMMP3MEN1MMP9HRH3
SCHEMBL14878474 0.85 L3MBTL1 (0.38) ALDH1A1HTTSMN1; SMN2KMT2AMMP3
SCHEMBL14878402 0.85 ITGA4 (0.37) ALDH1A1KMT2AMAPTMMP8MMP3

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
US-8426415-B2 Human ADAM-10 inhibitors SYMPHONY EVOLUTION, INC. (US) 2013-04-23 US disclosed
EP-2436676-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-04-04 EP disclosed