SCHEMBL4307013

SCHEMBL4307013

O=C(N[C@]1(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CCCNC1)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 2/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
TSHR P16473 1/20 0.35
BDKRB1 P46663 1/20 0.35
THRB P10828 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
SCHEMBL4006598 0.88 NPSR1 (0.41) MMP9KMT2AMEN1RAB9ALMNA
SCHEMBL4009267 0.87 HSD11B1 (0.39) KMT2AMEN1RAB9AMAPTLMNA
SCHEMBL4010824 0.84 EIF2AK3 (0.46) RAB9ANPSR1HTTSLC6A2SLC6A4
SCHEMBL4006918 0.84 ALDH1A1 (0.45) KMT2ALMNANPSR1ALDH1A1TSHR
SCHEMBL4004804 0.84 KMT2A (0.47) KMT2AMEN1RAB9AMAPTLMNA
SCHEMBL4004677 0.84 KMT2A (0.47) KMT2AMEN1RAB9AMAPTLMNA
SCHEMBL4005701 0.84 CXCR2 (0.36) KMT2AMEN1LMNAALDH1A1
SCHEMBL4006510 0.83 EPHX2 (0.47) KMT2AMEN1RAB9ALMNAALDH1A1
SCHEMBL4003899 0.83 EPHX2 (0.49) KMT2AMEN1LMNAALDH1A1TSHR
SCHEMBL4002524 0.82 EPHX2 (0.48) KMT2AMEN1RAB9AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP disclosed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP disclosed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO disclosed