SCHEMBL24962592

SCHEMBL24962592

N=C(/C(=C\N)c1ccc(Cl)cc1)c1ccncc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.44
▸ NT5E P21589 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ LMNA P02545 2/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ CYP19A1 P11511 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ AKR1C3 P42330 1/20 0.36
▸ KCNMA1 Q12791 1/20 0.36

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
SCHEMBL24963540 0.74 LMNA (0.47) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL24963385 0.73 LMNA (0.43) KMT2ANT5EMAPK1LMNAMEN1
SCHEMBL24964931 0.72 PIK3CA (0.51) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL24951261 0.71 MAPT (0.49) LMNASMN1; SMN2PTGS1PTGS2MAPT
SCHEMBL18657400 0.70 LMNA (0.59) MAPK1LMNAMAPTALDH1A1L3MBTL1
SCHEMBL15884550 0.68 NAPRT (0.37) KMT2AMAPK1LMNAMEN1SMN1; SMN2
SCHEMBL23410460 0.68 KMT2A (0.64) KMT2ANT5EMAPK1LMNAMEN1
SCHEMBL1156055 0.67 LMNA (0.63) KMT2ANT5EMAPK1LMNAMEN1
SCHEMBL5199645 0.67 CES2 (0.73) KMT2ANT5EMAPK1LMNAMEN1
4-Chloro-Benzoic Acid SCHEMBL28828177 0.66 TSHR (0.74) KMT2ANT5EMAPK1MEN1SMN1; 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-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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