SCHEMBL8011183

SCHEMBL8011183

O=C(c1ccccc1)c1cccc(Nc2ccc(-c3ccccc3)nn2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
ALDH1A1 P00352 6/20 0.55
NPC1 O15118 6/20 0.55
RAB9A P51151 6/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
DGAT1 O75907 1/20 0.51
TP53 P04637 4/20 0.51
LMNA P02545 3/20 0.51
POLB P06746 2/20 0.51
HPGD P15428 2/20 0.51
HTT P42858 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
THRB P10828 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ATM Q13315 1/20 0.45

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
SCHEMBL29818154 0.88 ALDH1A1 (0.54) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818042 0.88 ALDH1A1 (0.54) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL27040083 0.86 MAPT (0.58) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818048 0.84 NPC1 (0.71) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818190 0.83 DGAT1 (0.56) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818229 0.81 NPC1 (0.62) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818284 0.80 DGAT1 (0.53) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29817936 0.80 MAPT (0.66) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818096 0.80 MAPT (0.49) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29818159 0.79 DGAT1 (0.52) MAPTALDH1A1NPC1RAB9ASMN1; 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 4 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 claimed
WO-1998046574-A1 PYRIDAZINE AND PHTHALAZINE DERIVATIVES, PROCESS OF THEIR PREPARATION AND THEIR USE AS ANTICONVULSANTS SMITHKLINE BEECHAM PLC (GB) 1998-10-22 WO claimed
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