SCHEMBL24465646

SCHEMBL24465646

CNC(=O)CNC(=O)CCC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.41
CACNA1H O95180 1/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 1/20 0.35
HDAC4 P56524 1/20 0.33
ALDH1A1 P00352 2/20 0.33
SIGMAR1 Q99720 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
MCL1 Q07820 1/20 0.31
MLYCD O95822 1/20 0.31
PSMB5 P28074 1/20 0.30

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
SCHEMBL9482041 0.84 LMNA (0.48) CACNA1HLMNAALDH1A1SIGMAR1CNR1
SCHEMBL17662438 0.81 FAAH (0.44) RECQLCACNA1HGAALMNAALDH1A1
SCHEMBL17914454 0.81 RECQL (0.42) RECQLCACNA1HGAAALDH1A1SIGMAR1
SCHEMBL11433061 0.80 RECQL (0.40) RECQLCACNA1HGAAALDH1A1SIGMAR1
SCHEMBL23798940 0.79 FFAR1 (0.31) ALDH1A1
SCHEMBL19176775 0.78 HPGD (0.42) RECQLGAALMNAHDAC4ALDH1A1
SCHEMBL20096362 0.78 CACNA1H (0.40) RECQLCACNA1HGAAALDH1A1SIGMAR1
SCHEMBL10730053 0.78 ALDH1A1 (0.46) RECQLCACNA1HGAAALDH1A1SIGMAR1
SCHEMBL20206734 0.77 CYP2D6 (0.41) RECQLMLYCDPSMB5
SCHEMBL19176866 0.76 CNR1 (0.32) ALDH1A1SIGMAR1CNR1

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
EP-4006028-A1 IRAK4 KINASE INHIBITOR AND PREPARATION METHOD THEREFOR Zhuhai Yufan Biotechnologies Co., Ltd (CN) 2022-06-01 EP disclosed