SCHEMBL25790141

SCHEMBL25790141

C=NCc1cnc(C)nc1C1CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33
LMNA P02545 1/20 0.33
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
CYP1A2 P05177 1/20 0.31
TSHR P16473 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
SCHEMBL3825587 0.80 LMNA (0.40) HSD11B1LMNAPDK1PDK2
SCHEMBL3825081 0.78 LMNA (0.38) HSD11B1LMNAPDK1PDK2
Hydrochloric Acid SCHEMBL3825409 0.78 LMNA (0.39) HSD11B1LMNAPDK1PDK2TSHR
SCHEMBL25779726 0.68 HSD11B1 (0.36) HSD11B1LMNAPDK1PDK2
SCHEMBL15933175 0.68 HSD11B1 (0.36) HSD11B1PDK1PDK2
SCHEMBL25790841 0.66 HSD11B1 (0.38) HSD11B1PDK1PDK2
SCHEMBL14700224 0.63 PDK1 (0.38) HSD11B1PDK1PDK2
SCHEMBL1015670 0.63 HSD11B1 (0.50) HSD11B1
SCHEMBL3825584 0.62 HSD11B1 (0.49) HSD11B1
SCHEMBL3821041 0.62 CSNK1D (0.46) HSD11B1LMNATSHR

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-2023125928-A1 MENIN INHIBITOR AND USE THEREOF 成都先导药物开发股份有限公司 2023-07-06 WO disclosed