SCHEMBL16622156

SCHEMBL16622156

c1cc(N(c2ccc(OCC3CO3)cc2)c2ccc(OCC3CO3)cc2)ccc1OCCC1CO1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 4/20 0.50
TP53 P04637 3/20 0.50
TSHR P16473 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
HIF1A Q16665 2/20 0.50
PKM P14618 2/20 0.50
CYP1A2 P05177 1/20 0.50
PPARG P37231 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
CYP3A4 P08684 1/20 0.47
GLA P06280 1/20 0.38
FGFR1 P11362 1/20 0.36
SRC P12931 1/20 0.36
APP P05067 1/20 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
SCHEMBL279241 0.90 TDP1 (0.63) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL2623391 0.85 TDP1 (0.58) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL278981 0.85 TDP1 (0.58) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL12403309 0.84 TDP1 (0.53) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL279235 0.84 TDP1 (0.71) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL11179281 0.83 TDP1 (0.50) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL14507370 0.83 TDP1 (0.54) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL16641006 0.81 ALDH1A1 (0.48) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL13681406 0.81 TDP1 (0.46) TDP1ALDH1A1TP53TSHRMEN1
SCHEMBL17356542 0.81 TDP1 (0.53) TDP1ALDH1A1TP53TSHRMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8999624-B2 Developable bottom antireflective coating composition and pattern forming method using thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2015-04-07 US disclosed
US-8999624-B2 Developable bottom antireflective coating composition and pattern forming method using thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2015-04-07 US disclosed