SCHEMBL16640985

SCHEMBL16640985

Oc1ccc(C(c2ccc(OCC3CO3)cc2)c2ccc(OCC3CO3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 4/20 0.51
TP53 P04637 3/20 0.51
TSHR P16473 3/20 0.51
HIF1A Q16665 3/20 0.51
MAPT P10636 2/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PKM P14618 2/20 0.51
CYP1A2 P05177 2/20 0.51
LMNA P02545 2/20 0.51
PPARG P37231 1/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
CYP3A4 P08684 1/20 0.49
GLA P06280 1/20 0.39
FGFR1 P11362 1/20 0.36
SRC P12931 1/20 0.36
LTA4H P09960 1/20 0.36

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
SCHEMBL17897426 1.00 TDP1 (0.54) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL17897427 0.93 ALDH1A1 (0.49) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL17356545 0.92 TDP1 (0.63) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL15246778 0.92 TDP1 (0.63) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL14388708 0.92 TDP1 (0.63) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL50130 0.92 TDP1 (0.63) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL17359243 0.92 TDP1 (0.63) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL17898603 0.92 TDP1 (0.46) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL14345783 0.90 TDP1 (0.54) TDP1ALDH1A1TP53TSHRHIF1A
SCHEMBL12177535 0.90 TDP1 (0.54) TDP1ALDH1A1TP53TSHRHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080170-B1 INSERTION POLYNORBORNENE-BASED THERMOSET RESINS TRANSFERT PLUS SEC (CA) 2020-02-05 EP disclosed
US-9902803-B2 Epoxy compound having alkoxy silyl group, composition comprising same, cured product, use thereof and method for preparing epoxy compound having alkoxy silyl group KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2018-02-27 US disclosed
US-9902803-B2 Epoxy compound having alkoxy silyl group, composition comprising same, cured product, use thereof and method for preparing epoxy compound having alkoxy silyl group KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2018-02-27 US disclosed
US-20150105493-A1 EPOXY COMPOUND HAVING ALKOXY SILYL GROUP, COMPOSITION COMPRISING SAME, CURED PRODUCT, USE THEREOF AND METHOD FOR PREPARING EPOXY COMPOUND HAVING ALKOXY SILYL GROUP KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-04-16 US disclosed
US-20150105493-A1 EPOXY COMPOUND HAVING ALKOXY SILYL GROUP, COMPOSITION COMPRISING SAME, CURED PRODUCT, USE THEREOF AND METHOD FOR PREPARING EPOXY COMPOUND HAVING ALKOXY SILYL GROUP KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-04-16 US disclosed