SCHEMBL10697658

SCHEMBL10697658

c1ccc(C(c2ccc(OCC3CO3)cc2)c2ccc(OCC3CO3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.71
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
ALDH1A1 P00352 4/20 0.54
TP53 P04637 3/20 0.54
TSHR P16473 3/20 0.54
HIF1A Q16665 2/20 0.54
CYP3A4 P08684 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
PKM P14618 2/20 0.53
CYP1A2 P05177 1/20 0.53
PPARG P37231 1/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
GLA P06280 1/20 0.47
FGFR1 P11362 1/20 0.46
SRC P12931 1/20 0.46
GRM2 Q14416 2/20 0.44

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
SCHEMBL17552360 1.00 TDP1 (0.71) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL50130 0.93 TDP1 (0.63) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL17359243 0.93 TDP1 (0.63) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL17356545 0.93 TDP1 (0.63) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL15246778 0.93 TDP1 (0.63) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL14388708 0.93 TDP1 (0.63) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL10824445 0.89 TDP1 (0.69) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL3148179 0.87 TDP1 (0.67) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL28596670 0.87 TDP1 (0.67) TDP1MEN1KMT2AALDH1A1TP53
SCHEMBL4428715 0.86 TDP1 (0.65) TDP1MEN1KMT2AALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023176843-A1 LIQUID CRYSTAL DISPLAY ELEMENT SEALANT AND LIQUID CRYSTAL DISPLAY ELEMENT 積水化学工業株式会社 2023-09-21 WO disclosed
EP-0268713-A1 Demulsifier composition and method of use thereof PETROLITE CORPORATION (US) 1988-06-01 EP disclosed
US-4626379-A REACTION PRODUCT OF BLEND OF POLYOXYALKYLENE OXIDE COPOLYMER AND VINYL MONOMER PETROLITE CORPORATION (US) 1986-12-02 US disclosed
US-4502977-A REACTION PRODUCT OF BLEND OF OXYALKYLATED MATERIALS WITH VINYL MONOMER PETROLITE CORPORATION (US) 1985-03-05 US disclosed