SCHEMBL7208325

SCHEMBL7208325

Cc1ccc(OCC(CO)(CO)CO)c(C(C)(C)C)c1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNJ5 P48544 1/20 0.36
KCNJ3 P48549 1/20 0.36
CYP2C9 P11712 1/20 0.36
VDR P11473 4/20 0.33
HDAC3 O15379 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL28134012 0.80 KCNJ5 (0.30) KCNJ5KCNJ3
SCHEMBL8962428 0.78 ALOX15 (0.34) KCNJ5KCNJ3
SCHEMBL6552135 0.75 ALDH1A1 (0.38) KCNJ5KCNJ3KDM4E
SCHEMBL28760254 0.74
SCHEMBL7947269 0.74 SMN1; SMN2 (0.33) KCNJ5KCNJ3CYP2C9
SCHEMBL27487407 0.72 KDM4E (0.32) KDM4E
SCHEMBL28523010 0.72 USP2 (0.44) CYP2C9KDM4E
SCHEMBL27918526 0.70 ACHE (0.38) KDM4E
SCHEMBL16195513 0.69 ALDH1A1 (0.50) KDM4E
SCHEMBL27385131 0.69 HTR1B (0.49) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6612351-B1 Reduced rolling resistance and heat build up; durability THE GOODYEAR TIRE & RUBBER COMPANY 2003-09-02 US claimed
US-6612351-B1 Reduced rolling resistance and heat build up; durability THE GOODYEAR TIRE & RUBBER COMPANY 2003-09-02 US disclosed