SCHEMBL12016121

SCHEMBL12016121

CC1C[C@@H](Oc2cccc(F)c2)CCN1C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.52
▸ SLC6A4 P31645 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.52
▸ HRH3 Q9Y5N1 4/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MLNR O43193 2/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ GPR6 P46095 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40

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
SCHEMBL10077967 0.81 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3HRH3SMN1; SMN2
SCHEMBL10260953 0.80 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3HRH3SMN1; SMN2
SCHEMBL17339944 0.80 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3HRH3SMN1; SMN2
SCHEMBL10267101 0.79 HTR1F (0.48) HRH3
SCHEMBL10267816 0.79 HTR1F (0.48) HRH3
SCHEMBL10259186 0.79 HTR1F (0.48) HRH3
SCHEMBL13675029 0.79 HTR1F (0.48) HRH3
SCHEMBL4491580 0.79 HTR1F (0.48) HRH3
SCHEMBL28099496 0.76 POLB (0.41) KMT2AUSP2
SCHEMBL157429 0.75 SLC6A3 (0.67) SLC6A2SLC6A4SLC6A3

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
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 — — EP disclosed
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