SCHEMBL4754533

SCHEMBL4754533

Cc1ccc(S(=O)(=O)N2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.62
GAA P10253 2/20 0.62
ALDH1A1 P00352 3/20 0.57
STAT1 P42224 1/20 0.57
PKM P14618 4/20 0.56
POLB P06746 2/20 0.56
HTT P42858 2/20 0.56
MAOA P21397 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
THRB P10828 1/20 0.53
GPR183 P32249 1/20 0.53
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL3877038 0.88 LMNA (0.65) LMNAGAAALDH1A1STAT1PKM
SCHEMBL4646954 0.88 LMNA (0.65) LMNAGAAALDH1A1STAT1PKM
SCHEMBL4646949 0.88 LMNA (0.65) LMNAGAAALDH1A1STAT1PKM
SCHEMBL3932017 0.82 ALDH1A1 (0.55) GAAALDH1A1STAT1PKMHTT
SCHEMBL587788 0.82 CYP3A4 (0.68) LMNAGAAALDH1A1PKMMAOA
SCHEMBL22252719 0.79 POLB (0.56) ALDH1A1POLBSMN1; SMN2TSHRMAPK1
SCHEMBL1711115 0.78 PKM (0.85) LMNAALDH1A1PKMPOLBHTT
SCHEMBL4537086 0.78 PKM (0.88) LMNAGAAALDH1A1PKMPOLB
SCHEMBL10724066 0.78 PKM (0.88) LMNAGAAALDH1A1PKMPOLB
SCHEMBL8203532 0.78 PKM (0.88) LMNAGAAALDH1A1PKMPOLB

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-2008155777-A2 PROCESS FOR PREPARING EFLETRIZINE CADILA HEALTHCARE LIMITED (IN) 2008-12-24 WO claimed
WO-2008155777-A2 PROCESS FOR PREPARING EFLETRIZINE CADILA HEALTHCARE LIMITED (IN) 2008-12-24 WO disclosed