SCHEMBL7365802

SCHEMBL7365802

O=C(O)c1cccnc1C(=O)c1cccc(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
ALDH1A1 P00352 3/20 0.56
KDM4E B2RXH2 2/20 0.56
TSHR P16473 2/20 0.56
CYP3A4 P08684 1/20 0.56
ALOX15 P16050 1/20 0.56
BLM P54132 1/20 0.56
AGER Q15109 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
HTT P42858 1/20 0.49
TDP1 Q9NUW8 3/20 0.45
ABL1 P00519 1/20 0.44
RIN1 Q13671 1/20 0.44
PARP1 P09874 1/20 0.44
NPC1 O15118 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 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
SCHEMBL7366513 0.88 MAPT (0.56) MAPTALDH1A1KDM4ETSHRCYP3A4
SCHEMBL7361925 0.83 TDP1 (0.49) MAPTALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL8027078 0.83 TLR7 (0.50) MAPTALDH1A1TSHRCYP3A4L3MBTL1
SCHEMBL7347947 0.82 ALDH1A1 (0.69) MAPTALDH1A1KDM4ETSHRCYP3A4
SCHEMBL1251352 0.82 ALDH1A1 (0.56) MAPTALDH1A1KDM4ETSHRCYP3A4
SCHEMBL7361696 0.82 L3MBTL1 (0.56) MAPTALDH1A1KDM4ETSHRCYP3A4
SCHEMBL7370711 0.82 POLB (0.63) MAPTALDH1A1KDM4ETSHRCYP3A4
SCHEMBL6951317 0.81 DOT1L (0.47) MAPTALDH1A1TSHRCYP3A4MEN1
SCHEMBL7369369 0.79 ALDH1A1 (0.51) MAPTALDH1A1KDM4ETSHRCYP3A4
SCHEMBL7369371 0.79 FOLH1 (0.56) MAPTALDH1A1KDM4ETSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716954-A ANTIINFLAMMATORY AGENT, ANTIHISTAMINES, IMMUNOSUPPRESSION,AUTOIMMUNE DISEASES SYNTEX U.S.A. INC. (US) 1998-02-10 US disclosed
US-5405826-A Herbicidal pyridopyridazinones and pyridopyridazinethiones RHONE POULENC AGRICULTURE LIMITED (GB) 1995-04-11 US disclosed
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
EP-0555957-A1 Pyrido 2,3-d pyridazine derivatives as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-08-18 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed