SCHEMBL25815995

SCHEMBL25815995

CC(C)(C)c1noc2ccc3c(c12)CCCC(C(C)(C)C)C3

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL20132497 0.60 SIGMAR1 (0.52)
SCHEMBL14014968 0.59 NOS3 (0.49) KDM4EHPGDLMNASMN1; SMN2
SCHEMBL14014965 0.59 NOS3 (0.49) KDM4EHPGDLMNASMN1; SMN2
SCHEMBL1690358 0.59 NOS3 (0.49) KDM4EHPGDLMNASMN1; SMN2
SCHEMBL4548608 0.57 MAPT (0.42) KDM4EHPGDSMN1; SMN2
SCHEMBL20000788 0.56 CYP2D6 (0.42) SMN1; SMN2
SCHEMBL19840378 0.56 SIGMAR1 (0.55)
SCHEMBL21672511 0.56 MAPT (0.38) KDM4EHPGDLMNASMN1; SMN2
SCHEMBL22028572 0.56 LMNA (0.37) KDM4EHPGDLMNASMN1; SMN2
SCHEMBL14030410 0.55 MEN1 (0.38) KDM4EHPGDLMNASMN1; SMN2

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-2023125944-A1 COMPOUND CONTAINING HETEROCYCLIC RING 正大天晴药业集团股份有限公司 2023-07-06 WO disclosed