SCHEMBL5990327

SCHEMBL5990327

Oc1ccc(Cl)cc1Oc1ccc(F)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 2/20 0.47
▸ SCN10A Q9Y5Y9 2/20 0.47
▸ SLC6A2 P23975 3/20 0.46
▸ SLC6A3 Q01959 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ NR1I2 O75469 1/20 0.46
▸ TTR P02766 1/20 0.46
▸ PGR P06401 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HSPA5 P11021 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ CBR1 P16152 1/20 0.46
▸ TBXA2R P21731 1/20 0.46
▸ AGTR1 P30556 1/20 0.46
▸ SLC6A4 P31645 2/20 0.44
▸ TAS1R3 Q7RTX0 1/20 0.44
▸ TAS1R1 Q7RTX1 1/20 0.44
▸ TAS1R2 Q8TE23 1/20 0.44

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
SCHEMBL5990371 0.85 SCN8A (0.50) SCN8ASCN10ASLC6A2SLC6A3LMNA
SCHEMBL4504793 0.85 KDM4E (0.47) SLC6A2SLC6A3LMNANR1I2TTR
SCHEMBL5989716 0.79 HTR2C (0.48) SCN8ASCN10ALMNAMAPTHPGD
SCHEMBL10456772 0.78 TRPA1 (0.56) TRPA1HSPB1
SCHEMBL5990581 0.78 SCN8A (0.49) SCN8ASCN10ATRPA1
SCHEMBL19524125 0.77 SCN8A (0.43) SCN8ASCN10ASLC6A2SLC6A3LMNA
SCHEMBL4135441 0.77 TTR (0.75) SLC6A2SLC6A3LMNANR1I2TTR
SCHEMBL5991434 0.76 SCN8A (0.45) SCN8ASCN10ASLC6A2SLC6A3TTR
SCHEMBL5363263 0.76 SCN8A (0.57) SCN8ASCN10ALMNAHPGDTAS1R3
SCHEMBL5991900 0.75 PTGER4 (0.44) SLC6A2SLC6A3LMNASLC6A4KCNH2

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-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 — — US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 — — EP disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 — — WO disclosed
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