SCHEMBL29953983

SCHEMBL29953983

CCNS(=O)(=O)c1ccccc1B(O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.47
CA9 Q16790 5/20 0.47
ALOX5AP P20292 2/20 0.44
FEN1 P39748 2/20 0.44
ALDH1A1 P00352 5/20 0.42
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RECQL P46063 1/20 0.40
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C9 P11712 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL29956224 0.86 CA12 (0.60) CA12CA9ALDH1A1LMNARECQL
SCHEMBL4020469 0.83 CA12 (0.62) CA12CA9ALDH1A1LMNASMN1; SMN2
SCHEMBL29958156 0.79 CYP1A2 (0.49) ALOX5APFEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL344268 0.79 CYP1A2 (0.49) ALOX5APFEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL1816382 0.78 CA12 (0.50) CA12CA9ALOX5APFEN1ALDH1A1
SCHEMBL289765 0.77 PSIP1 (0.45) CA12CA9ALDH1A1LMNASMN1; SMN2
SCHEMBL29670227 0.77 PSIP1 (0.45) CA12CA9ALDH1A1LMNASMN1; SMN2
SCHEMBL519774 0.76 NSD2 (0.47) ALOX5APFEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL29442141 0.76 NSD2 (0.47) ALOX5APFEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL6034914 0.76 TSHR (0.55) LMNASMN1; SMN2KDM4EKMT2AGAA

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