SCHEMBL6570588

SCHEMBL6570588

Cc1ccc2c(c1C)OC(O)(CCl)CO2

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL6567597 0.82 MAP3K14 (0.33)
SCHEMBL6567367 0.74 KDM4E (0.40) ALDH1A1SMN1; SMN2
SCHEMBL6569068 0.70 ALOX15 (0.39) SMN1; SMN2
SCHEMBL6567593 0.70 PARP1 (0.39) KMT2A
SCHEMBL6568369 0.68 MEN1 (0.38) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6569099 0.68 TAAR1 (0.36) KMT2A
SCHEMBL6569100 0.68 MEN1 (0.38) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6570579 0.66 CALM1 (0.38)
SCHEMBL6567663 0.65 USP2 (0.36) ALDH1A1KMT2AHSD17B10
SCHEMBL6567576 0.65 TAAR1 (0.35) SMN1; SMN2

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
EP-1405851-A1 Method for producing seven-membered diether compounds and intermediates thereof Takasago International Corporation (JP) 2004-04-07 EP disclosed