SCHEMBL9138367

SCHEMBL9138367

Cn1nc2cccnc2c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 1/20 0.46
▸ PRMT5 O14744 1/20 0.43
▸ HRH4 Q9H3N8 1/20 0.42
▸ LMNA P02545 2/20 0.39
▸ HSP90AA1 P07900 3/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ PSMB5 P28074 1/20 0.38
▸ MAOB P27338 2/20 0.37
▸ MAPT P10636 3/20 0.37
▸ CCNT1 O60563 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CCNB1 P14635 1/20 0.37
▸ CCND1 P24385 1/20 0.37
▸ CCNE1 P24864 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ CDK9 P50750 1/20 0.37
▸ NOS3 P29474 1/20 0.36
▸ NOS1 P29475 1/20 0.36

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
SCHEMBL14430215 0.78 GRM4 (0.43) GRM4PRMT5HRH4LMNAHSP90AA1
SCHEMBL17261297 0.77 HSP90AA1 (0.42) PRMT5HRH4LMNAHSP90AA1HSP90AB1
SCHEMBL23067956 0.74 GRM4 (0.41) GRM4PRMT5HRH4LMNAHSP90AA1
SCHEMBL17112234 0.73 SMN1; SMN2 (0.42) LMNAMAOBMAPTNPC1KDM4E
SCHEMBL27359785 0.73 GRM4 (0.40) GRM4PRMT5HRH4LMNAHSP90AA1
SCHEMBL2914480 0.71 MAPT (0.46) HRH4LMNAMAPTKDM4EHTT
SCHEMBL31052526 0.71 HSP90AA1 (0.43) PRMT5HRH4LMNAHSP90AA1HSP90AB1
SCHEMBL17045432 0.71 HSP90AA1 (0.43) PRMT5HRH4LMNAHSP90AA1HSP90AB1
SCHEMBL9123512 0.70 GRM4 (0.62) GRM4LMNAMAPTNPC1L3MBTL1
SCHEMBL9058058 0.67 KDM4E (0.50) PRMT5LMNAHSP90AA1MAPTNPC1

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
US-5457200-A Oxidative coupling reactions for determination of hydrogen peroxide BOEHRINGER MANNHEIM (DE) 1995-10-10 — — US claimed
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