SCHEMBL1668617

SCHEMBL1668617

CS(=O)(=O)N1CCC(c2cc(F)c(OC3CN(CCc4ccc(C(F)(F)F)cc4)C3)c(F)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
RORC P51449 1/20 0.40
KCNH2 Q12809 3/20 0.38
EPHX2 P34913 1/20 0.38
KCNA5 P22460 1/20 0.38
CNR1 P21554 1/20 0.37
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
JAK3 P52333 1/20 0.36
MCHR1 Q99705 1/20 0.36
IDO1 P14902 1/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
DRD3 P35462 1/20 0.36
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL1668765 0.95 KDM4E (0.40) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL1668410 0.92 KDM4E (0.49) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL12198265 0.90 KDM4E (0.41) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL1668262 0.88 KDM4E (0.48) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL12198321 0.86 KDM4E (0.52) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL1668516 0.85 LMNA (0.38) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL1668787 0.83 KDM4E (0.51) KDM4EALDH1A1LMNAKMT2ARORC
SCHEMBL1671394 0.82 EPHX2 (0.46) KDM4EALDH1A1LMNAKCNH2EPHX2
SCHEMBL2511739 0.81 LMNA (0.40) KDM4ELMNAKMT2ARORCEPHX2
SCHEMBL1668633 0.81 LMNA (0.38) KDM4EALDH1A1LMNAKMT2ARORC

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
EP-2486033-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2012-08-15 EP claimed
WO-2011044001-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-04-14 WO claimed