SCHEMBL6388995

SCHEMBL6388995

[CH]1OC=CC=C1N1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 5/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ HTT P42858 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ KDM4E B2RXH2 4/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ TP53 P04637 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ KMO O15229 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ ADRA2B P18089 1/20 0.31

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
SCHEMBL8864811 0.83 — —
SCHEMBL8065587 0.82 — —
SCHEMBL6276533 0.64 LMNA (0.36) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL30724578 0.63 LMNA (0.35) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL16501134 0.61 LMNA (0.38) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL24378167 0.60 LMNA (0.36) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL1993537 0.60 LMNA (0.36) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL31560438 0.60 LMNA (0.36) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL30425332 0.60 LMNA (0.36) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL30015637 0.60 LMNA (0.36) LMNAMAPTALDH1A1MEN1KMT2A

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-6884804-B2 Inhibitors of Src and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2005-04-26 — — US claimed
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