SCHEMBL24439711

SCHEMBL24439711

CC(Oc1ccc2c3ccccc3n(C)c2c1)C(=O)NCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.56
RECQL P46063 2/20 0.56
PTGS2 P35354 1/20 0.51
ALDH1A1 P00352 5/20 0.50
MAPT P10636 5/20 0.50
HPGD P15428 4/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 1/20 0.50
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 2/20 0.47
POLB P06746 2/20 0.47
THRB P10828 1/20 0.47
GAA P10253 1/20 0.47
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
EGFR P00533 1/20 0.46
SRC P12931 1/20 0.46
NPC1 O15118 1/20 0.45

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
SCHEMBL29605692 0.90 MAPT (0.52) KDM4ERECQLALDH1A1MAPTHPGD
SCHEMBL24439709 0.90 MAPT (0.52) KDM4ERECQLALDH1A1MAPTHPGD
SCHEMBL24439765 0.80 HPGD (0.59) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL29605285 0.80 HPGD (0.59) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL24439852 0.78 SMN1; SMN2 (0.53) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL29605150 0.78 SMN1; SMN2 (0.53) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL11216889 0.77 PPARG (0.54) KDM4ERECQLPTGS2ALDH1A1MAPT
SCHEMBL29606995 0.75 PTPN1 (0.54) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL24439766 0.73 MEN1 (0.58) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL29605252 0.73 MEN1 (0.58) KDM4EALDH1A1MAPTHPGDTSHR

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-2022103149-A1 NOVEL CARBAZOLE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME AS ACTIVE INGREDIENT 주식회사 큐라클 2022-05-19 WO disclosed