SCHEMBL29954779

SCHEMBL29954779

Nc1ccc(O)c(C=O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 12/20 0.57
CDK1 P06493 1/20 0.50
TRIM24 O15164 1/20 0.48
TRIM33 Q9UPN9 1/20 0.48
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
TNF P01375 1/20 0.47
CYP3A4 P08684 1/20 0.47
HSPD1 P10809 1/20 0.47
THRB P10828 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.47
KDR P35968 1/20 0.47
BRCA1 P38398 1/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL6380412 1.00 ERN1 (0.57) ERN1CDK1TRIM24TRIM33KDM4E
Hydrochloric Acid SCHEMBL31191963 0.98 ERN1 (0.55) ERN1CDK1TRIM24TRIM33KDM4E
SCHEMBL29955412 0.84 ERN1 (0.67) ERN1
SCHEMBL2558331 0.84 ERN1 (0.67) ERN1
5-Bromosalicylaldehyde SCHEMBL28103357 0.82 ERN1 (0.81) ERN1CDK1KDM4EALDH1A1ALOX15
SCHEMBL6029813 0.82 TYR (0.52) ERN1TRIM24TRIM33KDM4EMEN1
SCHEMBL2554069 0.79 ERN1 (0.65) ERN1
SCHEMBL11664879 0.78 LMNA (0.46) KDM4EMEN1ALDH1A1CYP3A4THRB
SCHEMBL22630789 0.77 CA1 (0.46) KDM4EMEN1ALDH1A1TNFCYP3A4
SCHEMBL3679569 0.77 CA1 (0.46) KDM4EMEN1ALDH1A1TNFCYP3A4

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