SCHEMBL7660882

SCHEMBL7660882

COC(=O)c1ccc(C=CCc2cncn2C)cc1-c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
GRM2 Q14416 1/20 0.40
NAMPT P43490 4/20 0.39
NPC1 O15118 1/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
TUBB4A P04350 3/20 0.35
TUBB P07437 3/20 0.35
TUBA3C P0DPH7 3/20 0.35
TUBA1B P68363 3/20 0.35
TUBA4A P68366 3/20 0.35
TUBB4B P68371 3/20 0.35
TUBB3 Q13509 3/20 0.35

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
SCHEMBL7660875 1.00 SLC6A4 (0.42) SLC6A4SLC6A3GRM2NAMPTNPC1
SCHEMBL7667000 0.89 NAMPT (0.39) GRM2NAMPTKCNA3GSK3BDYRK1A
SCHEMBL7667006 0.89 NAMPT (0.39) GRM2NAMPTKCNA3GSK3BDYRK1A
SCHEMBL7665864 0.84 SLC6A4 (0.41) SLC6A4SLC6A3GRM2NPC1CASP3
SCHEMBL7665869 0.84 SLC6A4 (0.41) SLC6A4SLC6A3GRM2NPC1CASP3
SCHEMBL7668232 0.81 SLC6A4 (0.42) SLC6A4SLC6A3GRM2NAMPTNPC1
SCHEMBL7668237 0.81 SLC6A4 (0.42) SLC6A4SLC6A3GRM2NAMPTNPC1
SCHEMBL7661039 0.80 SLC6A3 (0.55) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7661041 0.80 SLC6A3 (0.55) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7672140 0.80 SLC6A4 (0.43) SLC6A4SLC6A3NAMPTNPC1CASP3

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-6486156-B1 Chemical compounds ASTRAZENECA AB (SE) 2002-11-26 US disclosed
EP-1140858-A2 ARYLPROPENYLIMIDAZOLES AS FARNESYL-PROTEIN TRANSFERASE INHIBITORS AstraZeneca AB (SE) 2001-10-10 EP disclosed
WO-2000039716-A2 ARYLPROPENYLIMIDAZOLES AS FARNESYL-PROTEIN TRANSFERASE INHIBITORS ASTRAZENECA AB (SE) 2000-07-06 WO disclosed