SCHEMBL29953877

SCHEMBL29953877

O=Cc1c[nH]c2c(F)cc(Cl)cc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.43
TRIM24 O15164 1/20 0.40
TRIM33 Q9UPN9 1/20 0.40
PIM3 Q86V86 7/20 0.38
PIM1 P11309 5/20 0.38
ERN1 O75460 3/20 0.37
CYP2A6 P11509 2/20 0.37
IMPDH2 P12268 1/20 0.37
PIM2 Q9P1W9 1/20 0.36
GPR84 Q9NQS5 1/20 0.35
MAP2 P11137 1/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
PTPN1 P18031 1/20 0.34

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
SCHEMBL2534005 0.82 GPR84 (0.53) ARTRIM24TRIM33PIM3PIM1
SCHEMBL671157 0.82 ERN1 (0.44) ARTRIM24TRIM33PIM3PIM1
SCHEMBL29955987 0.81 ERN1 (0.47) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL29952505 0.79 TRIM24 (0.40) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL672970 0.79 TRIM24 (0.56) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL2425476 0.79 ERN1 (0.47) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL29953212 0.79 PIM3 (0.49) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL13961179 0.79 TRIM24 (0.40) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL21356468 0.79 HTR1A (0.40) TRIM24TRIM33PIM3PIM1ERN1
SCHEMBL17828249 0.76 TRIM24 (0.47) ARTRIM24TRIM33PIM3PIM1

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