SCHEMBL16434909

SCHEMBL16434909

O=[N+]([O-])c1ccc(Cn2cnc(N3CCN(c4ccc(F)cc4)CC3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.60
▸ KMT2A Q03164 4/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ ENPP2 Q13822 1/20 0.49
▸ MAPT P10636 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HTT P42858 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ KCNJ1 P48048 1/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ SIGMAR1 Q99720 1/20 0.44
▸ SIRT6 Q8N6T7 2/20 0.44
▸ ADRB1 P08588 1/20 0.44

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
SCHEMBL16434921 0.82 KMT2A (0.47) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL16423441 0.82 POLB (0.56) POLBKMT2AMEN1ENPP2MAPT
SCHEMBL16434955 0.80 SMO (0.50) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL11550138 0.80 POLB (0.75) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL12005574 0.78 POLB (1.00) POLBKMT2AMEN1ENPP2MAPT
SCHEMBL16434957 0.76 MAPT (0.47) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL16434782 0.76 MAPT (0.55) POLBKMT2AMEN1MAPTALDH1A1
SCHEMBL17770462 0.74 POLB (0.69) POLBKMT2AMEN1ENPP2MAPT
SCHEMBL16434979 0.73 LMNA (0.41) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL16434882 0.72 ALDH1A1 (0.44) POLBKMT2AMEN1MAPTALDH1A1

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
EP-2832728-A1 TRIAZINONE COMPOUND AND T-TYPE CALCIUM CHANNEL INHIBITOR Nissan Chemical Industries, Ltd. (JP) 2015-02-04 — — EP disclosed
Send feedback