SCHEMBL9475974

SCHEMBL9475974

CCc1c(OCc2ccccc2)c(=O)ccn1CCCO

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ NPC1 O15118 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.48
▸ POLB P06746 1/20 0.44
▸ MAPK14 Q16539 3/20 0.43
▸ MAOB P27338 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ PGR P06401 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ EPHX2 P34913 1/20 0.38

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 SCHEMBL9485329 0.99 HTT (0.52) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL9476339 0.98 HTT (0.53) HTTSMN1; SMN2MEN1ALDH1A1HPGD
Hydrochloric Acid SCHEMBL9476013 0.96 HTT (0.52) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL8663227 0.93 HTT (0.55) HTTSMN1; SMN2MEN1ALDH1A1HPGD
Hydrochloric Acid SCHEMBL8662185 0.91 HTT (0.54) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL30982433 0.88 HTT (0.53) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL30982430 0.88 HTT (0.53) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL30983025 0.88 HTT (0.53) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL30887389 0.87 HTT (0.58) HTTSMN1; SMN2MEN1ALDH1A1HPGD
SCHEMBL9700018 0.85 HTT (0.53) HTTSMN1; SMN2MEN1ALDH1A1HPGD

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-5256676-A 3-hydroxy-pyridin-4-ones useful for treating parasitic infections BRITISH TECHNOLOGY GROUP LIMITED (GB) 1993-10-26 — — US disclosed
Send feedback