SCHEMBL8181769

SCHEMBL8181769

O=C(O)c1ccc(NCC(c2ccc(F)cc2)c2ncc[nH]2)cc1-c1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.38
STING1 Q86WV6 1/20 0.38
FNTA P49354 4/20 0.35
FNTB P49356 4/20 0.35
BRS3 P32247 1/20 0.35
MAOB P27338 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
DHODH Q02127 2/20 0.34
PGGT1B P53609 3/20 0.34
FAAH O00519 2/20 0.34
FPR2 P25090 2/20 0.34
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
EIF4E P06730 1/20 0.34
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
FABP4 P15090 1/20 0.34
F2RL1 P55085 1/20 0.33

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
SCHEMBL8188962 0.91 SLC6A4 (0.41) FNTAFNTBMAOBPGGT1BFAAH
SCHEMBL8182943 0.84 FNTA (0.43) FNTAFNTBPGGT1B
SCHEMBL8173083 0.83 FNTA (0.56) FNTAFNTBPGGT1B
SCHEMBL8174313 0.82 FNTA (0.43) FNTAFNTBPGGT1B
SCHEMBL8172862 0.81 FNTA (0.46) FNTAFNTBPGGT1B
SCHEMBL8181381 0.81 FNTA (0.52) FNTAFNTBPGGT1B
SCHEMBL8173067 0.81 FNTA (0.59) FNTAFNTBPGGT1B
SCHEMBL8185111 0.78 BRS3 (0.38) PPARABRS3DHODHEIF4EKDM5A
SCHEMBL8185336 0.76 SLC6A4 (0.41) PPARAKDM4EALDH1A1
SCHEMBL8194262 0.76 SMN1; SMN2 (0.41) BRS3XDHEIF4EKDM5AKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054865-A1 FARNESYL TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
EP-1025089-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 2000-08-09 EP disclosed
WO-1999041235-A1 FARNESYL TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed
WO-1999020612-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-04-29 WO disclosed