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SCHEMBL8670310

SCHEMBL8670310

CC=C([Si](c1ccccc1)(c1ccccc1)c1ccccc1)[PH](O)(O[C@H]1C[C@H](n2cnc3c(=O)[nH]c(NC(=O)C(C)C)nc32)O[C@@H]1COC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1)N(C(C)C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.47
▸ TYMP P19971 9/20 0.41
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ POLA1 P09884 1/20 0.33
▸ NT5E P21589 1/20 0.31
▸ HPGD P15428 1/20 0.30

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
SCHEMBL26190487 0.86 KDM4E (0.53) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL3820892 0.86 KDM4E (0.56) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL8669460 0.85 TYMP (0.39) TYMP
SCHEMBL21828783 0.83 KDM4E (0.53) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL14062506 0.83 KDM4E (0.53) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL17911710 0.83 KDM4E (0.53) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL14063336 0.83 KDM4E (0.53) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL31556051 0.83 TYMP (0.59) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL21828784 0.83 TYMP (0.59) KDM4ETYMPTAS1R3TAS1R1POLA1
SCHEMBL12714672 0.83 TYMP (0.59) KDM4ETYMPTAS1R3TAS1R1POLA1

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-5705621-A Oligomeric phosphite, phosphodiester, Phosphorothioate and phosphorodithioate compounds and intermediates for preparing same ISIS PHARMACEUTICALS, INC. (US) 1998-01-06 — — US disclosed