SCHEMBL26519908

SCHEMBL26519908

N=C(NCc1ccc(-c2ccccc2)cc1)c1cccc(N)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.47
NR1H4 Q96RI1 2/20 0.47
HDAC1 Q13547 4/20 0.46
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAOA P21397 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KLKB1 P03952 1/20 0.43
CFD P00746 1/20 0.43
PRSS1 P07477 2/20 0.42

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
SCHEMBL26485477 0.91 CYP1A2 (0.47) HDAC2HDAC8HDAC6ALDH1A1MAOA
SCHEMBL26485497 0.86 EPHX2 (0.45) EPHX2NR1H4HDAC1HDAC3HDAC4
SCHEMBL26517166 0.84 CYP2C9 (0.45) ALDH1A1LMNAMAPTPRSS1PRSS2
SCHEMBL7606673 0.83 EPHX2 (0.68) EPHX2NR1H4HDAC1HDAC3HDAC4
SCHEMBL26485572 0.81 GAA (0.44) ALDH1A1LMNAMAPTPRSS1PRSS2
SCHEMBL26108034 0.81 EPHX2 (0.48) EPHX2NR1H4HDAC1HDAC3HDAC4
SCHEMBL26106061 0.74 CFD (0.46) EPHX2NR1H4HDAC2HDAC8HDAC6
SCHEMBL456940 0.74 THRB (0.54) HDAC1HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL26485506 0.74 TERT (0.42) EPHX2NR1H4HDAC1HDAC3HDAC4
SCHEMBL26482808 0.73 CYP1A2 (0.47) EPHX2HDAC2HDAC8HDAC6ALDH1A1

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
WO-2023183886-A2 COMPOSITIONS FOR AND METHODS OF MODULATING RNA STABILITY DUKE UNIVERSITY (US) 2023-09-28 WO disclosed