SCHEMBL9537650

SCHEMBL9537650

O=C1CC(c2cc(F)ccc2O)=NN1c1nc2ccccc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.54
▸ LMNA P02545 4/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ POLB P06746 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ GAA P10253 1/20 0.54
▸ MAOB P27338 4/20 0.53
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.44
▸ ALOX15 P16050 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ RAB9A P51151 4/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ HTT P42858 3/20 0.39

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
SCHEMBL9538451 0.87 MAPT (0.60) MAPTLMNAMEN1POLBKMT2A
SCHEMBL9541467 0.80 MAPT (0.60) MAPTLMNAMEN1POLBKMT2A
SCHEMBL186009 0.71 MEN1 (0.61) MAPTLMNAMEN1POLBKMT2A
SCHEMBL9533173 0.71 MAOB (0.65) MAPTLMNAMEN1KMT2AGAA
SCHEMBL9379932 0.71 MEN1 (0.64) MAPTLMNAMEN1POLBKMT2A
SCHEMBL2791070 0.71 MAPT (0.69) MAPTLMNAMEN1POLBKMT2A
SCHEMBL12297633 0.69 MAPT (0.58) MAPTLMNAMEN1POLBKMT2A
SCHEMBL32690204 0.69 CYP1A2 (1.00) MAPTLMNAMEN1POLBKMT2A
SCHEMBL3529132 0.69 CYP1A2 (0.55) MAPTLMNAMEN1POLBKMT2A
SCHEMBL9532937 0.68 MAOB (0.62) MAPTMEN1POLBKMT2AGAA

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
WO-1993003036-A1 BENZOPYRANO[4,3-c]PYRAZOLES, THEIR PREPARATION AND THEIR USE AS IMMUNOMODULATORS THE BOOTS COMPANY PLC (GB) 1993-02-18 — — WO disclosed
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