SCHEMBL11250307

SCHEMBL11250307

CC(=O)c1ccc(F)cc1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
MAPT P10636 3/20 0.47
HDAC7 Q8WUI4 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.43
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
TP53 P04637 1/20 0.41
PTGS1 P23219 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PTGS2 P35354 2/20 0.41
FABP2 P12104 1/20 0.41
TSHR P16473 1/20 0.41
AKR1C4 P17516 1/20 0.41
ADRA2B P18089 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2C P28335 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
SCHEMBL29519530 1.00 HTT (0.48) HTTMAPTHDAC7LTB4R2SLC6A4
SCHEMBL28126166 0.86 HTT (0.51) HTTMAPTLTB4R2SLC6A4SLC6A3
SCHEMBL5024503 0.85 LTB4R2 (0.51) HTTMAPTLTB4R2MEN1KMT2A
SCHEMBL2645320 0.83 MAPK14 (0.54) MAPTMEN1KMT2AAKR1C3AKR1C2
SCHEMBL1927478 0.82 BCAT2 (0.61) HTTMAPT
SCHEMBL10794588 0.82 DHODH (0.54) MAPTLTB4R2MEN1KMT2AAKR1C2
SCHEMBL11435938 0.81 MAPT (0.53) HTTMAPTHDAC7SMN1; SMN2PTGS1
SCHEMBL14397839 0.81 KEAP1 (0.48) LTB4R2CES2CES1MEN1KMT2A
SCHEMBL14397837 0.81 CYP2C9 (0.50) HTTMAPTLTB4R2PTGS1PTGS2
SCHEMBL14398096 0.81 CYP2C9 (0.50) HTTMAPTLTB4R2PTGS1PTGS2

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
EP-0015776-B1 1,1'-BIPHENYL-2-YL ALKYLAMINE DERIVATIVES, THEIR PRODUCTION AND CARDIOVASCULAR PREPARATIONS CONTAINING SAME ELI LILLY AND COMPANY (US) 1982-06-30 EP disclosed
US-4277471-A 1,1-Biphenyl-2-yl alkylamines, formulations and antiarrhythmic treatment ELI LILLY AND COMPANY (US) 1981-07-07 US disclosed
EP-0015776-A1 1,1'-Biphenyl-2-yl alkylamine derivatives, their production and cardiovascular preparations containing same ELI LILLY AND COMPANY (US) 1980-09-17 EP disclosed