SCHEMBL6232014

SCHEMBL6232014

CCCCCNc1ccccc1F

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
PSIP1 O75475 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH3 Q9ULD8 1/20 0.44
CNR2 P34972 4/20 0.42
SIGMAR1 Q99720 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
TLR8 Q9NR97 1/20 0.41
CNR1 P21554 1/20 0.41
CHRM2 P08172 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL29563275 1.00 SMN1; SMN2 (0.53) SMN1; SMN2PSIP1L3MBTL1MEN1KMT2A
SCHEMBL27489390 0.94 SMN1; SMN2 (0.58) SMN1; SMN2PSIP1L3MBTL1HDAC3HDAC1
SCHEMBL6233644 0.86 PSIP1 (0.50) SMN1; SMN2PSIP1L3MBTL1LMNAGAA
SCHEMBL1724131 0.86 L3MBTL1 (0.51) SMN1; SMN2L3MBTL1KCNH3CNR2SIGMAR1
SCHEMBL15690948 0.84 SMN1; SMN2 (0.44) SMN1; SMN2L3MBTL1MEN1KMT2AKCNH3
SCHEMBL11266466 0.84 L3MBTL1 (0.54) SMN1; SMN2L3MBTL1KCNH3CNR2SIGMAR1
SCHEMBL30174089 0.84 L3MBTL1 (0.54) SMN1; SMN2L3MBTL1KCNH3CNR2SIGMAR1
SCHEMBL8535750 0.84 L3MBTL1 (0.54) SMN1; SMN2L3MBTL1KCNH3CNR2SIGMAR1
SCHEMBL11266453 0.84 L3MBTL1 (0.54) SMN1; SMN2L3MBTL1KCNH3CNR2SIGMAR1
SCHEMBL1926387 0.80 L3MBTL1 (0.48) SMN1; SMN2L3MBTL1KCNH3CNR2SIGMAR1

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
US-5116982-A Fluorination DOWELANCO (US) 1992-05-26 US claimed
EP-1530562-A1 OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME Central Glass Company, Limited (JP) 2005-05-18 EP disclosed
WO-2004022521-A1 OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME CENTRAL GLASS COMPANY, LIMITED (JP) 2004-03-18 WO disclosed