SCHEMBL8148398

SCHEMBL8148398

COc1ccccc1P(c1cccc2ccccc12)c1cccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
NQO1 P15559 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ACHE P22303 2/20 0.41
BCHE P06276 1/20 0.41
SLC6A4 P31645 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL15658563 0.84 MAPT (0.58) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL50148 0.84 CA1 (0.60) MAPTALDH1A1CA12CA1CA2
SCHEMBL29405044 0.84 CA1 (0.60) MAPTALDH1A1CA12CA1CA2
SCHEMBL10414766 0.84 CA1 (0.60) MAPTALDH1A1CA12CA1CA2
SCHEMBL6869783 0.82 CA1 (0.57) MAPTALDH1A1CA12CA1CA2
SCHEMBL5713309 0.82 CA1 (0.57) MAPTALDH1A1CA12CA1CA2
SCHEMBL15658840 0.82 CA1 (0.57) MAPTALDH1A1CA12CA1CA2
Hydrochloric Acid SCHEMBL7972166 0.82 CA1 (0.57) MAPTALDH1A1CA12CA1CA2
SCHEMBL29390280 0.82 ALDH1A1 (0.50) ALDH1A1CA12CA1CA2CA4
SCHEMBL135987 0.82 ALDH1A1 (0.50) ALDH1A1CA12CA1CA2CA4

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-2000002890-A1 HYDROFORMYLATION PROCESS NESTE CHEMICALS OY (FI) 2000-01-20 WO disclosed