SCHEMBL5335241

SCHEMBL5335241

CC(C)(C)CCCNc1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 3/20 0.41
▸ MAPT P10636 5/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ XBP1 P17861 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ PRSS1 P07477 4/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ SSTR3 P32745 1/20 0.35
▸ STK17A Q9UEE5 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.35
▸ F2 P00734 2/20 0.35
▸ PRSS2 P07478 2/20 0.35
▸ PRSS3 P35030 2/20 0.35

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
SCHEMBL5309004 0.94 KCNH3 (0.44) KCNH3MAPTALDH1A1MEN1KMT2A
SCHEMBL5308535 0.88 MAPT (0.43) KCNH3MAPTALDH1A1MEN1KMT2A
SCHEMBL9362324 0.78 MAPT (0.39) KCNH3MAPTALDH1A1PRSS1STK17A
SCHEMBL19669165 0.78 F2 (0.40) MAPTALDH1A1F2
SCHEMBL13328983 0.78 LOXL2 (0.39) ALDH1A1HTTSMN1; SMN2GAA
SCHEMBL12932913 0.77 ALDH1A1 (0.40) MAPTALDH1A1MEN1KMT2ANPC1
SCHEMBL8244931 0.77 KCNH3 (0.57) KCNH3MAPTALDH1A1KMT2AMAPK1
SCHEMBL1567049 0.75 KCNH3 (0.65) KCNH3MAPTALDH1A1KMT2AHTT
Hydrochloric Acid SCHEMBL7393433 0.75 KCNH3 (0.60) KCNH3MAPTALDH1A1KMT2AMAPK1
SCHEMBL2064760 0.75 MAPT (0.57) KCNH3MAPTALDH1A1MEN1KMT2A

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
WO-2007038571-A2 PROLYL HYDROXYLASE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-05 — — WO disclosed
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