SCHEMBL8129591

SCHEMBL8129591

Nc1nc(N)nc(-c2ccc(/C=C/c3ccc([N+](=O)[O-])cc3)cc2)n1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ APP P05067 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ FBP1 P09467 1/20 0.49
▸ PTGS2 P35354 5/20 0.47
▸ PTGS1 P23219 2/20 0.47
▸ CYP19A1 P11511 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ HPGD P15428 1/20 0.44
▸ BCHE P06276 1/20 0.43
▸ MAOB P27338 1/20 0.43

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
SCHEMBL8129593 1.00 MAPT (0.54) MAPTNPC1RAB9AAPPTDP1
SCHEMBL9566556 0.90 MAPT (0.58) MAPTNPC1RAB9AAPPTDP1
SCHEMBL6983254 0.89 MAPT (0.61) MAPTNPC1RAB9ATDP1LMNA
SCHEMBL24320972 0.83 RAB9A (0.59) MAPTNPC1RAB9ALMNACYP19A1
SCHEMBL6984517 0.80 CYP19A1 (0.48) MAPTNPC1RAB9ATDP1LMNA
SCHEMBL11375992 0.79 APP (0.69) MAPTNPC1RAB9AAPPLMNA
SCHEMBL11375977 0.79 APP (0.69) MAPTNPC1RAB9AAPPLMNA
SCHEMBL29769219 0.77 XDH (0.58) MAPTNPC1RAB9AAPPTDP1
SCHEMBL458177 0.77 APP (0.78) MAPTNPC1RAB9AAPPFBP1
SCHEMBL458178 0.77 APP (0.78) MAPTNPC1RAB9AAPPFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1290264-A Triazine angiogenesis inhibitors ABBOTT LAB (US) 2001-04-04 — — CN claimed
EP-1037886-A1 TRIAZINE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2000-09-27 — — EP claimed
WO-1999031088-A1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 1999-06-24 — — WO claimed
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