SCHEMBL9325828

SCHEMBL9325828

CCCOc1cc(-c2ccc(NN)nn2)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
USP2 O75604 3/20 0.47
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
FPR2 P25090 11/20 0.44
AGTR1 P30556 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.42

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
SCHEMBL9616208 0.85 MAPT (0.44) MAPTUSP2ALOX15TSHRFPR2
SCHEMBL9325535 0.84 FPR2 (0.47) MAPTFPR2MEN1KMT2AALDH1A1
SCHEMBL9325859 0.82 FPR2 (0.47) MAPTFPR2MEN1KMT2AALDH1A1
SCHEMBL9185156 0.81 MAPT (0.44) MAPTUSP2ALOX15TSHRFPR2
SCHEMBL9264673 0.81 MAPT (0.44) MAPTUSP2ALOX15TSHRAGTR1
SCHEMBL9268561 0.79 TRPC6 (0.46) MAPTUSP2FPR2MEN1KMT2A
SCHEMBL9266782 0.77 PDE4D (0.54) MAPTUSP2ALOX15TSHRAGTR1
SCHEMBL9179120 0.76 MAPT (0.43) MAPTUSP2FPR2MEN1KMT2A
SCHEMBL9180526 0.75 MAPT (0.48) MAPTUSP2ALOX15TSHRFPR2
SCHEMBL9616213 0.73 FPR2 (0.41) MAPTUSP2ALOX15TSHRFPR2

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-0581805-A1 NOVEL PYRIDAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1994-02-09 EP disclosed
WO-1992019602-A1 NOVEL PYRIDAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1992-11-12 WO disclosed