SCHEMBL29956169

SCHEMBL29956169

CC(C)c1ccc2oc(N)c(C=O)c(=O)c2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPG P10696 1/20 0.68
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
LMNA P02545 1/20 0.63
MAPK1 P28482 1/20 0.63
KDM4E B2RXH2 2/20 0.57
THRB P10828 1/20 0.57
PTPN1 P18031 1/20 0.55
TBK1 Q9UHD2 10/20 0.53
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
IKBKE Q14164 2/20 0.47
ABCC4 O15439 1/20 0.47
TTR P02766 1/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
ADRA1A P35348 1/20 0.47
OPRD1 P41143 1/20 0.47
PDE4D Q08499 1/20 0.47
PDE3A Q14432 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
SCHEMBL29096713 1.00 ALPG (0.68) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL29954496 0.81 ALPG (1.00) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL30947813 0.78 KMT2A (1.00) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL29950811 0.78 MEN1 (0.68) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL11360521 0.78 MEN1 (0.68) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL29951128 0.78 KMT2A (0.68) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL29956923 0.78 KMT2A (1.00) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL28774085 0.78 PTPN1 (0.49) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL10823592 0.77 ALPG (0.68) ALPGMEN1KMT2ALMNAMAPK1
SCHEMBL11377296 0.77 MAPK1 (1.00) ALPGMEN1KMT2ALMNAMAPK1

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