SCHEMBL9302812

SCHEMBL9302812

C=CC(=O)OCCOS(=O)(=O)c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.49
TSHR P16473 5/20 0.41
ALDH1A1 P00352 5/20 0.41
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP3A4 P08684 2/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
GAA P10253 2/20 0.37
ALOX5 P09917 1/20 0.36
ATM Q13315 1/20 0.36
ALOX12 P18054 1/20 0.34

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
SCHEMBL28013355 0.87 THRB (0.40) THRBTSHRALDH1A1HIF1APOLB
SCHEMBL8654494 0.82 KMT2A (0.45) ALDH1A1TP53POLBCYP1A2CYP2C9
SCHEMBL11608946 0.81 POLB (0.42) THRBTSHRALDH1A1POLBCYP1A2
SCHEMBL11607742 0.80 THRB (0.58) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL7470086 0.79 POLB (0.44) THRBALDH1A1POLBCYP1A2CYP2C9
SCHEMBL8746171 0.78 MEN1 (0.41) ALDH1A1POLBHPGDCYP1A2CYP2C9
SCHEMBL3182778 0.78 ALDH1A1 (0.42) THRBTSHRALDH1A1TP53POLB
SCHEMBL27738550 0.78 POLB (0.43) THRBALDH1A1POLBCYP1A2CYP2C9
SCHEMBL8746163 0.78 CA2 (0.42) ALDH1A1TP53POLBCYP1A2CYP2C9
SCHEMBL28516553 0.77 POLB (0.40) ALDH1A1POLBCYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5284752-A Methods of preparing a polymeric latex composition and water-insoluble biological reagent EASTMAN KODAK COMPANY (US) 1994-02-08 US disclosed
US-5234841-A Methods of preparing a polymeric latex composition and water-insoluble biological reagent EASTMAN KODAK COMPANY (US) 1993-08-10 US disclosed
US-5149416-A Water soluble, crosslinked acrylamide bases copolymer EASTMAN KODAK COMPANY (US) 1992-09-22 US disclosed
US-5073603-A Acrylamide-based EASTMAN KODAK COMPANY (US) 1991-12-17 US disclosed
US-5053443-A Methods of preparing a polymeric latex composition and water-insoluble biological reagent EASTMAN KODAK COMPANY (US) 1991-10-01 US disclosed
US-5043062-A Particles with surface reactive groups linked to biological ligands EASTMAN KODAK COMPANY (US) 1991-08-27 US disclosed
US-4997772-A Shell-core polymers EASTMAN KODAK COMPANY (US) 1991-03-05 US disclosed