SCHEMBL6232362

SCHEMBL6232362

CCCCCNc1cccc(OC(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ICMT O60725 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
ABL1 P00519 1/20 0.42
PIM1 P11309 2/20 0.42
SLC22A12 Q96S37 1/20 0.42
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
EPHX2 P34913 1/20 0.41
SYK P43405 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
SCHEMBL2096490 0.98 ICMT (0.45) ICMTNPC1RAB9AMTNR1AMTNR1B
SCHEMBL6233653 0.89 PIM1 (0.50) ICMTNPC1RAB9AMTNR1AMTNR1B
SCHEMBL7505384 0.84 MTNR1B (0.59) ICMTMTNR1AMTNR1BABL1EPHX2
SCHEMBL6232118 0.84 HDAC3 (0.41) NPC1RAB9AABL1
SCHEMBL5177248 0.84 ICMT (0.46) ICMTNPC1RAB9APIM1SLC22A12
SCHEMBL5604615 0.83 MTNR1B (0.57) ICMTMTNR1AMTNR1BABL1EPHX2
SCHEMBL11641239 0.83 MTNR1B (0.57) ICMTMTNR1AMTNR1BABL1EPHX2
Hydrochloric Acid SCHEMBL14744123 0.83 ICMT (0.46) ICMTNPC1RAB9APIM1SLC22A12
Hydrochloric Acid SCHEMBL7505379 0.83 MTNR1B (0.57) ICMTMTNR1AMTNR1BABL1EPHX2
SCHEMBL6230410 0.81 POLB (0.54) RAB9AABL1EPHX2

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-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