SCHEMBL7672140

SCHEMBL7672140

COC(=O)c1ccc(C=CCc2cnc[nH]2)cc1-c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HTR3E A5X5Y0 2/20 0.39
HTR3B O95264 2/20 0.39
HTR3A P46098 2/20 0.39
HTR3D Q70Z44 2/20 0.39
HTR3C Q8WXA8 2/20 0.39
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
TUBB4A P04350 2/20 0.37
TUBB P07437 2/20 0.37
TUBA3C P0DPH7 2/20 0.37
TUBA1B P68363 2/20 0.37
TUBA4A P68366 2/20 0.37
TUBB4B P68371 2/20 0.37

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
SCHEMBL7672136 1.00 SLC6A4 (0.43) SLC6A4SLC6A3HTR3EHTR3BHTR3A
SCHEMBL7668198 0.88 BCL2L1 (0.38) NAMPTCYP3A4
SCHEMBL7668202 0.88 BCL2L1 (0.38) NAMPTCYP3A4
SCHEMBL7866842 0.83 SLC6A4 (0.42) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7661041 0.81 SLC6A3 (0.55) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7661039 0.81 SLC6A3 (0.55) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7673796 0.80 SLC6A4 (0.43) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7673802 0.80 SLC6A4 (0.43) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7660875 0.80 SLC6A4 (0.42) SLC6A4SLC6A3NPC1CASP3RAB9A
SCHEMBL7660882 0.80 SLC6A4 (0.42) SLC6A4SLC6A3NPC1CASP3RAB9A

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