SCHEMBL916478

SCHEMBL916478

CCC(c1ccc2ccccc2c1)P(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ UGT2B7 P16662 1/20 0.49
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ AOC3 Q16853 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ ATM Q13315 1/20 0.42
▸ SLC6A2 P23975 4/20 0.42
▸ SLC6A4 P31645 4/20 0.42
▸ SLC6A3 Q01959 4/20 0.42
▸ KCNH2 Q12809 2/20 0.42
▸ CETP P11597 1/20 0.41
▸ ACP3 P15309 1/20 0.41
▸ MMP9 P14780 1/20 0.41

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
Magnesium SCHEMBL916872 0.98 UGT2B7 (0.47) UGT2B7MEN1KMT2ACYP2D6GLA
SCHEMBL27339195 0.85 CYP2C9 (0.51) CYP2D6CYP1A2TSHRHIF1ASLC6A2
Potassium Ion SCHEMBL31688383 0.82 UGT2B7 (0.43) UGT2B7MEN1KMT2ACYP2D6GLA
SCHEMBL31688376 0.82 UGT2B7 (0.43) UGT2B7MEN1KMT2ACYP2D6GLA
Potassium Ion SCHEMBL916943 0.82 UGT2B7 (0.43) UGT2B7MEN1KMT2ACYP2D6GLA
SCHEMBL3817936 0.78 ACP3 (0.63) ACP3
SCHEMBL5057999 0.78 KMT2A (0.45) KMT2ACYP2D6ATMSLC6A2SLC6A4
SCHEMBL5052932 0.78 AKR1C3 (0.46) UGT2B7GLASLC6A2SLC6A4SLC6A3
SCHEMBL4284921 0.77 UGT2B7 (0.58) UGT2B7MEN1KMT2ACYP2D6GLA
SCHEMBL5051156 0.77 UTS2R (0.41) CYP2D6GLASLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868126-B2 Process for producing polyester, polyester produced using said process, and polyester molded product TOYO BOSEKI KABUSHIKI KAISHA (JP) 2011-01-11 — — US disclosed
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