SCHEMBL8024061

SCHEMBL8024061

COc1ccccc1Nc1ccc(-c2ccccc2)nn1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.76
NPC1 O15118 4/20 0.76
RAB9A P51151 4/20 0.76
ALDH1A1 P00352 4/20 0.76
GAA P10253 2/20 0.76
MAPK10 P53779 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
KMT2A Q03164 5/20 0.49
MEN1 O00255 3/20 0.49
USP2 O75604 3/20 0.49
LMNA P02545 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
EGFR P00533 1/20 0.48
ABL1 P00519 1/20 0.47
YES1 P07947 1/20 0.47
KDM4E B2RXH2 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.47

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
SCHEMBL8025377 0.79 MAPT (0.47) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL180923 0.77 DGAT1 (0.49) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL2300032 0.75 MEN1 (0.75) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL1752922 0.73 RAB9A (0.62) MAPTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3191755 0.72 MAPT (0.69) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL28975916 0.72 MAPT (0.62) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL2404530 0.71 NPC1 (0.50) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL29858889 0.71 ALOX5 (0.81) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL3406539 0.71 ALOX5 (0.81) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL3678840 0.70 JAK2 (0.56) MAPTNPC1RAB9AALDH1A1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975605-A1 PYRIDAZINE AND PHTHALAZINE DERIVATIVES, PROCESS OF THEIR PREPARATION AND THEIR USE AS ANTICONVULSANTS SMITHKLINE BEECHAM PLC (GB) 2000-02-02 EP disclosed
WO-1998046574-A1 PYRIDAZINE AND PHTHALAZINE DERIVATIVES, PROCESS OF THEIR PREPARATION AND THEIR USE AS ANTICONVULSANTS SMITHKLINE BEECHAM PLC (GB) 1998-10-22 WO disclosed