SCHEMBL18653152

SCHEMBL18653152

C=C(CC)C[C@H](C)C(=C)Nc1ccc(C(C)CC[C@@H](C)c2ccc(C)c(C)c2)cc1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL18653128 0.84 SMN1; SMN2 (0.34) GAAHPGDSMN1; SMN2
SCHEMBL18653163 0.81 GAA (0.34) GAAHPGDSMN1; SMN2
SCHEMBL18653130 0.81 RIPK1 (0.35) GAAHPGDSMN1; SMN2
SCHEMBL18653070 0.78 SMN1; SMN2 (0.36) GAAHPGDSMN1; SMN2
SCHEMBL18653233 0.77 MAPT (0.35) GAAHPGDSMN1; SMN2
SCHEMBL18653224 0.76 SMN1; SMN2 (0.35) GAAHPGDSMN1; SMN2
SCHEMBL18653134 0.71 LMNA (0.41) GAAHPGD
SCHEMBL20707118 0.69 SMN1; SMN2 (0.39) GAAHPGDSMN1; SMN2
SCHEMBL18653174 0.68 IDO1 (0.33) —
SCHEMBL18653239 0.66 LMNA (0.38) HPGD

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-2678334-B1 ANTI-VIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2017-03-22 — — EP disclosed
Send feedback