SCHEMBL29954065

SCHEMBL29954065

CCOC(=O)c1cc(B(O)O)ccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.60
CYP4A11 Q02928 1/20 0.60
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.47
ALDH1A1 P00352 3/20 0.47
BAZ2B Q9UIF8 1/20 0.46
BAZ2A Q9UIF9 1/20 0.46
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA12 O43570 3/20 0.45
CA9 Q16790 3/20 0.45
CA7 P43166 2/20 0.44
CA14 Q9ULX7 2/20 0.44
MAPK1 P28482 1/20 0.43
METTL3 Q86U44 1/20 0.42
HSD17B10 Q99714 1/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 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
SCHEMBL364895 1.00 CYP4F2 (0.60) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL15286075 0.88 CYP4F2 (0.49) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL29954716 0.88 CYP4F2 (0.49) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL29712893 0.82 MEN1 (0.50) KMT2ATSHRALDH1A1CA1CA2
SCHEMBL660617 0.82 MEN1 (0.50) KMT2ATSHRALDH1A1CA1CA2
SCHEMBL473842 0.81 TSHR (0.47) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL28855354 0.81 CA12 (0.50) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL11225504 0.80 CYP4F2 (0.67) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL2406530 0.80 CYP4F2 (0.67) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL27835348 0.80 CYP4F2 (0.58) CYP4F2CYP4A11KMT2ATSHRALDH1A1

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