SCHEMBL29954589

SCHEMBL29954589

Cc1nccc2c(C=O)c[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.56
TRIM33 Q9UPN9 1/20 0.56
KMT2A Q03164 2/20 0.47
PIM3 Q86V86 9/20 0.47
PIM1 P11309 7/20 0.43
PIM2 Q9P1W9 2/20 0.43
DYRK1B Q9Y463 1/20 0.42
CYP2A6 P11509 2/20 0.41
IMPDH2 P12268 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CYP1A2 P05177 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
GABRA1 P14867 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL29956271 0.81 TRIM24 (0.49) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL29952712 0.79 PIM3 (0.48) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL29951661 0.79 KMT2A (0.47) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL13909727 0.79 PIM3 (0.48) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL29954304 0.79 TRIM24 (0.47) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL12693836 0.79 KMT2A (0.47) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL29956847 0.79 TRIM24 (0.47) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL29957087 0.76 TRIM24 (0.44) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL29954104 0.76 KMT2A (0.44) TRIM24TRIM33KMT2APIM3PIM1
SCHEMBL14519078 0.75 PIM3 (0.65) TRIM24TRIM33KMT2APIM3PIM1

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