SCHEMBL9060210

SCHEMBL9060210

CCCc1ccc(-c2ccc(SC(F)F)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40
MAP4K4 O95819 1/20 0.39
ABL1 P00519 1/20 0.39
NTRK1 P04629 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
CSF1R P07333 1/20 0.39
RET P07949 1/20 0.39
IGF1R P08069 1/20 0.39
PDGFRB P09619 1/20 0.39
FGFR1 P11362 1/20 0.39
FLT1 P17948 1/20 0.39
LTK P29376 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
CLK2 P49760 1/20 0.39

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
SCHEMBL9060666 0.89 RARB (0.47) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9062316 0.88 RARB (0.49) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9062062 0.86 HSD17B10 (0.51) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9061215 0.86 HSD17B10 (0.51) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9061921 0.86 HSD17B10 (0.51) MAPTLMNAMEN1KMT2AHTT
SCHEMBL10337753 0.86 HSD17B10 (0.51) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9061219 0.86 HSD17B10 (0.51) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9060216 0.86 HSD17B10 (0.51) MAPTLMNAMEN1KMT2AHTT
SCHEMBL10337773 0.86 RARB (0.47) MAPTLMNAMEN1KMT2AHTT
SCHEMBL9061824 0.85 MAP4K4 (0.40) MAPTLMNAMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5536442-A ELECTROOPTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-07-16 US disclosed
US-5389292-A Liquid crystalline media having positive dielctric anisotropy, chemical, heat and radiation resistance, used as electro-optical displaying MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-14 US disclosed
EP-0381728-B1 DIFLUOROMETHYL COMPOUNDS MERCK PATENT GMBH (DE) 1993-12-08 EP disclosed
EP-0381728-A1 DIFLUOROMETHYL COMPOUNDS. MERCK PATENT GMBH (DE) 1990-08-16 EP disclosed
WO-1990001056-A1 DIFLUOROMETHYL COMPOUNDS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-02-08 WO disclosed