SCHEMBL10261500

SCHEMBL10261500

CN1CCC(Oc2cc(NC(=O)c3ccc(F)cc3Cl)ccc2Cl)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR1F P30939 7/20 0.59
▸ MAPK7 Q13164 1/20 0.47
▸ SCD O00767 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ WDR5 P61964 1/20 0.45
▸ HTR1A P08908 2/20 0.44
▸ HTR1D P28221 2/20 0.44
▸ HTR1B P28222 2/20 0.44
▸ SLC5A7 Q9GZV3 1/20 0.43
▸ RORC P51449 1/20 0.43

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
Hydrochloric Acid SCHEMBL4498126 0.99 HTR1F (0.58) HTR1FMAPK7SCDRAB9AHPGD
SCHEMBL10261919 0.93 HTR1F (0.54) HTR1FMAPK7SCDRAB9ANPC1
Hydrochloric Acid SCHEMBL4506091 0.92 HTR1F (0.53) HTR1FMAPK7SCDRAB9ANPC1
SCHEMBL4506973 0.92 HTR1F (0.58) HTR1FRAB9AHPGDNPC1WDR5
SCHEMBL10267494 0.86 GRM4 (0.51) RAB9ANPC1RORC
SCHEMBL10267789 0.86 HTR1F (0.57) HTR1FHPGDWDR5
Hydrochloric Acid SCHEMBL4509011 0.85 GRM4 (0.50) RAB9ANPC1RORC
Hydrochloric Acid SCHEMBL4507131 0.85 HTR1F (0.56) HTR1FHPGDWDR5
SCHEMBL10267808 0.84 HTR1F (0.53) HTR1FMAPK7SCDHTR1DSLC5A7
Hydrochloric Acid SCHEMBL4509359 0.84 HTR1F (0.52) HTR1FMAPK7SCDHTR1DSLC5A7

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
EP-1626958-B1 (PIPERIDINYLOXY)PHENYL, (PIPERIDINYLOXY)PYRIDINYL, (PIPERIDINYLSULFANYL)PHENYL AND (PIPERIDINYLSULFANYL)PYRIDINYL COMPOUNDS AS 5-HT 1F AGONISTS LILLY CO ELI (US) 2012-06-27 — — EP disclosed
US-7608629-B2 (Piperidinyloxy)phenyl, (piperidinyloxy)pyridinyl, (piperidinylsulfanyl)phenyl and (piperidinylsulfanyl)pyridinyl compounds as 5-HT1F agonists ELI LILLY AND COMPANY (US) 2009-10-27 — — US disclosed
US-7608629-B2 (Piperidinyloxy)phenyl, (piperidinyloxy)pyridinyl, (piperidinylsulfanyl)phenyl and (piperidinylsulfanyl)pyridinyl compounds as 5-HT1F agonists ELI LILLY AND COMPANY (US) 2009-10-27 — — US disclosed
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