SCHEMBL24964826

SCHEMBL24964826

C/C(N)=C(/C(=N)c1ccncc1C)c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.37
▸ SIRT3 Q9NTG7 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ IDO1 P14902 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ NPC1 O15118 3/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ CYP11B2 P19099 2/20 0.32
▸ MAP4K4 O95819 2/20 0.32
▸ CSNK2A2 P19784 1/20 0.32
▸ CSNK2B P67870 1/20 0.32
▸ KMT2A Q03164 3/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ NT5E P21589 1/20 0.31
▸ KCNH2 Q12809 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
SCHEMBL24963385 0.80 LMNA (0.43) LMNAPOLBKMT2AMEN1NT5E
SCHEMBL24963420 0.71 LMNA (0.41) LMNAPOLBNPC1RAB9A
SCHEMBL24963538 0.71 CCR9 (0.38) LMNAIDO1POLBMAP4K4
SCHEMBL11001665 0.70 TDP1 (0.50) SIRT3TDP1KMT2AMEN1
SCHEMBL24964824 0.70 LMNA (0.54) LMNATDP1IDO1POLBNPC1
SCHEMBL24964991 0.70 CES2 (0.48) LMNAPOLBKMT2A
SCHEMBL24963419 0.69 LMNA (0.36) LMNATDP1POLBNPC1RAB9A
SCHEMBL24962589 0.69 PROKR1 (0.39) LMNAPOLBMAP4K4KCNH2
SCHEMBL24962584 0.68 LMNA (0.50) LMNAIDO1POLB
SCHEMBL24964808 0.66 CNR1 (0.37) LMNAPOLBMAP4K4

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-2023004280-A1 SELECTIVE PYRAZOLE LRRK2 INHIBITORS AND METHODS FOR USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-01-26 — — WO disclosed
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