SCHEMBL29956834

SCHEMBL29956834

O=Cc1cc(F)cnc1O

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 12/20 0.48
AGBL2 Q5U5Z8 1/20 0.37
HCAR2 Q8TDS4 1/20 0.35
SPR P35270 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
SCHEMBL22105601 1.00 ERN1 (0.48) ERN1AGBL2HCAR2SPR
SCHEMBL29954200 0.78 ERN1 (0.42) ERN1AGBL2HCAR2
SCHEMBL8364837 0.75 ERN1 (0.34) ERN1
SCHEMBL16382668 0.75 TRIM24 (0.44) ERN1AGBL2HCAR2
SCHEMBL31265477 0.75 ERN1 (0.48) ERN1
SCHEMBL2119952 0.75 ERN1 (0.39) ERN1AGBL2HCAR2
SCHEMBL1619507 0.75 ERN1 (0.54) ERN1
SCHEMBL124004 0.75 ERN1 (0.39) ERN1AGBL2HCAR2
SCHEMBL4140207 0.75 AGBL2 (0.41) ERN1AGBL2HCAR2
SCHEMBL14115886 0.75 ERN1 (0.48) ERN1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed