SCHEMBL11181589

SCHEMBL11181589

COC(COc1ccc(OCC(CC2CO2)OC)cc1)CC1CO1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.49
CYP2C9 P11712 2/20 0.49
ALDH1A1 P00352 5/20 0.42
HPGD P15428 4/20 0.42
TP53 P04637 3/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
HIF1A Q16665 2/20 0.42
CYP1A2 P05177 1/20 0.42
PPARG P37231 1/20 0.42
PKM P14618 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GLA P06280 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM1A O60341 1/20 0.33

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
SCHEMBL28383691 0.77 SMN1; SMN2 (0.32) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL16968399 0.77 ALDH1A1 (0.36) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL11335733 0.76 TDP1 (0.50) TSHRALDH1A1TP53MEN1KMT2A
SCHEMBL10050541 0.76 TSHR (0.76) TSHRCYP2C9ALDH1A1HPGDTP53
SCHEMBL8510541 0.75 HPGD (0.49) TSHRALDH1A1HPGDTP53MAPT
SCHEMBL10050546 0.73 TSHR (0.70) TSHRCYP2C9ALDH1A1HPGDTP53
SCHEMBL20457156 0.72 KMT2A (0.78) TSHRALDH1A1HPGDTP53MAPT
SCHEMBL20457158 0.72 ALDH1A1 (0.68) TSHRCYP2C9ALDH1A1HPGDTP53
SCHEMBL11322753 0.71 TDP1 (0.44) TSHRALDH1A1TP53MEN1KMT2A
SCHEMBL11322757 0.71 TDP1 (0.44) TSHRALDH1A1TP53MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4383054-A Hydrophilic high polymers prepared from aqueous solutions or dispersions of polyoxypropylene polyamine N-N'-polymethylene sulfonates TEXACO INC. (US) 1983-05-10 US disclosed
US-4272384-A Composition for preventing a resin system from setting up in a well bore THE DOW CHEMICAL COMPANY (US) 1981-06-09 US disclosed
US-4189002-A Method for rigless zone abandonment using internally catalyzed resin system THE DOW CHEMICAL COMPANY (US) 1980-02-19 US disclosed
US-4101474-A Aqueous based epoxy slurry for forming a consolidated gravel pack THE DOW CHEMICAL COMPANY (US) 1978-07-18 US disclosed
US-4081030-A EPOXY RESIN, CURING AGENT, SOLVENT, COUPLING AGENT, QUATERNARY AMMONIUM HALIDE SURFACTANT, AND A PARTICULATE MATERIAL THE DOW CHEMICAL COMPANY (US) 1978-03-28 US disclosed
US-4074760-A OIL RECOVERY THE DOW CHEMICAL COMPANY (US) 1978-02-21 US disclosed