SCHEMBL24920814

SCHEMBL24920814

COc1cncc(-c2cnon2)n1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.39
CYP11B1 P15538 1/20 0.38
LRRK2 Q5S007 1/20 0.34
SYK P43405 3/20 0.33
PIM1 P11309 2/20 0.32
PIM3 Q86V86 2/20 0.32
PIM2 Q9P1W9 2/20 0.32
BACE1 P56817 2/20 0.30
FFAR4 Q5NUL3 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
SCHEMBL24921148 0.77 BTK (0.46)
SCHEMBL24921984 0.73 SIRT6 (0.37)
SCHEMBL24921966 0.73 MAOB (0.39)
SCHEMBL3063023 0.71 CYP11B2 (0.41) CYP11B2CYP11B1FFAR4
SCHEMBL1177955 0.71
SCHEMBL24920823 0.70 CYP2C19 (0.41)
SCHEMBL27876948 0.69
SCHEMBL24920817 0.69 CYP11B2 (0.38) CYP11B2CYP11B1LRRK2SYKPIM1
SCHEMBL24920887 0.69 CYP11B2 (0.38) CYP11B2CYP11B1LRRK2
SCHEMBL24920802 0.69 LRRK2 (0.38) CYP11B2CYP11B1LRRK2SYKPIM1

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-2023006097-A1 BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER 海创药业股份有限公司 2023-02-02 WO disclosed