SCHEMBL7671975

SCHEMBL7671975

O=C(O)c1ccc(C=CCc2nccn2Cc2ccccc2)cc1-c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.49
AGTR2 P50052 1/20 0.49
RAB9A P51151 1/20 0.40
KCNA3 P22001 3/20 0.40
GRM2 Q14416 2/20 0.40
LMNA P02545 1/20 0.39
HSP90AA1 P07900 2/20 0.39
BCL2L1 Q07817 1/20 0.38
BAD Q92934 1/20 0.38
HSP90B1 P14625 1/20 0.37
HDAC1 Q13547 1/20 0.36

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
SCHEMBL7671974 1.00 AGTR1 (0.49) AGTR1AGTR2RAB9AKCNA3GRM2
SCHEMBL7660976 0.90 HSP90AA1 (0.45) AGTR1AGTR2RAB9AKCNA3GRM2
SCHEMBL7660971 0.90 HSP90AA1 (0.45) AGTR1AGTR2RAB9AKCNA3GRM2
SCHEMBL7674887 0.84 NAMPT (0.39) AGTR1AGTR2KCNA3GRM2BCL2L1
SCHEMBL7674885 0.84 NAMPT (0.39) AGTR1AGTR2KCNA3GRM2BCL2L1
SCHEMBL7672485 0.82 FNTA (0.50)
SCHEMBL7672482 0.82 FNTA (0.50)
SCHEMBL7663134 0.74 SLC6A4 (0.41) RAB9AKCNA3HSP90AA1HSP90B1
SCHEMBL7663143 0.74 SLC6A4 (0.41) RAB9AKCNA3HSP90AA1HSP90B1
SCHEMBL7668237 0.74 SLC6A4 (0.42) RAB9AKCNA3GRM2LMNAHSP90AA1

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