SCHEMBL24899985

SCHEMBL24899985

CCN(CC)c1cc(C(C)C)cc(Cl)n1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
KMT2A Q03164 1/20 0.54
HTT P42858 1/20 0.41
CRHR1 P34998 10/20 0.40
POLB P06746 1/20 0.34
CASR P41180 1/20 0.33
PGK1 P00558 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL16451486 0.84 KDM4E (0.38) KDM4EKMT2AHTTCRHR1
SCHEMBL5018836 0.76 NFKB1 (0.38)
SCHEMBL1425326 0.76 KMT2A (0.59) KDM4EKMT2AHTTCRHR1POLB
SCHEMBL1603021 0.73 KMT2A (0.67) KDM4EKMT2AHTTCRHR1POLB
SCHEMBL20642343 0.72 ESR1 (0.35) KDM4EKMT2ACRHR1
SCHEMBL2790492 0.72 KDM4E (0.65) KDM4EKMT2AHTTCRHR1POLB
SCHEMBL12484062 0.71 KMT2A (0.46) KDM4EKMT2AHTTCRHR1PGK1
SCHEMBL9073351 0.70 KMT2A (1.00) KDM4EKMT2AHTTCRHR1POLB
SCHEMBL2562194 0.70 KDM4E (0.53) KDM4EKMT2AHTTCRHR1
SCHEMBL16019521 0.69 CRHR1 (0.41) KDM4EKMT2ACRHR1CASR

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-2023283921-A1 DPD INHIBITOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 北京深蓝泰医药科技有限公司 2023-01-19 WO disclosed