SCHEMBL31422457

SCHEMBL31422457

CCO/C=C/c1cccc(Cn2cnnn2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ TBXAS1 P24557 1/20 0.34
▸ HMOX1 P09601 1/20 0.33
▸ PDE4B Q07343 2/20 0.33
▸ ALDH1A1 P00352 4/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ LTA4H P09960 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ PTGS2 P35354 1/20 0.31

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
SCHEMBL4544236 0.78 KDM4E (0.47) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL29788847 0.70 KDM4E (0.50) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL10965028 0.70 KDM4E (0.50) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL2163185 0.70 L3MBTL1 (0.50) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL31422371 0.70 KDM4E (0.50) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL29788851 0.70 L3MBTL1 (0.53) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL5593844 0.69 KAT2B (0.44) KMT2AKDM4ESMN1; SMN2HPGDALDH1A1
SCHEMBL2532477 0.69 CYP19A1 (0.55) MEN1KMT2ACYP1A2CYP2C9KDM4E
SCHEMBL31422525 0.68 HDAC3 (0.33) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL9978689 0.67 CYP19A1 (0.53) MEN1KMT2ACYP1A2CYP2C9KDM4E

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-2025085560-A1 LYSINE ACETYLTRANSFERASE INHIBITORS Kronos Bio, Inc. (US) 2025-04-24 — — WO disclosed
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