SCHEMBL8535683

SCHEMBL8535683

CSc1ccc(C(O)CCCCCCc2ncc[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.45
TERT O14746 1/20 0.35
HRH4 Q9H3N8 2/20 0.35
TAAR1 Q96RJ0 6/20 0.33
FAAH O00519 3/20 0.32
SLC6A4 P31645 1/20 0.32
HTR1A P08908 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MMP12 P39900 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL8537671 0.82 TBXAS1 (0.45) TBXAS1TERTHTR1ASMN1; SMN2
SCHEMBL8538862 0.82 TBXAS1 (0.45) TBXAS1TERTHTR1ASMN1; SMN2
SCHEMBL8536865 0.80 TBXAS1 (0.46) TBXAS1TERTHRH4TAAR1SLC6A4
SCHEMBL8540514 0.77 TBXAS1 (0.44) TBXAS1TERTTAAR1SLC6A4
SCHEMBL8536355 0.76 TBXAS1 (0.57) TBXAS1L3MBTL1
SCHEMBL8542267 0.75 TBXAS1 (0.49) TBXAS1TERTHRH4TAAR1HTR1A
SCHEMBL27232031 0.73 TBXAS1 (0.54) TBXAS1TERTHRH4TAAR1HTR1A
SCHEMBL4129898 0.73 TBXAS1 (0.54) TBXAS1TERTHRH4TAAR1HTR1A
SCHEMBL503743 0.72 TBXAS1 (0.69) TBXAS1TERTTAAR1HTR1ASMN1; SMN2
SCHEMBL28062565 0.72 TBXAS1 (0.69) TBXAS1TERTTAAR1HTR1ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750532-A TETRAHYDROPYRIMIDINE-2,4-DIONE DERIVATIVES, VIRICIDES, ANTIINFLAMMATORY AGENTS, PAF INHIBITORS SCHERING CORPORATION (US) 1998-05-12 US disclosed