SCHEMBL28800294

SCHEMBL28800294

ClCc1nccn1CC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2B6 P20813 1/20 0.41
PDE1C Q14123 6/20 0.40
PDE1A P54750 4/20 0.40
PDE1B Q01064 4/20 0.40
YTHDC1 Q96MU7 1/20 0.37
OPRD1 P41143 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP11B2 P19099 1/20 0.36
BRD4 O60885 2/20 0.34
PKM P14618 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
CHRM5 P08912 2/20 0.33
CASP1 P29466 1/20 0.33
CASP4 P49662 1/20 0.33
CASP5 P51878 1/20 0.33
ADRA2C P18825 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33

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
Hydrochloric Acid SCHEMBL5655405 0.93 PDE1C (0.35) CYP2B6PDE1CPDE1APDE1BYTHDC1
Hydrochloric Acid SCHEMBL5657275 0.90 BRD4 (0.34) PDE1CCYP11B2BRD4KDM4C
SCHEMBL5657494 0.78 KCNH2 (0.39) CYP2B6PDE1CPDE1APDE1BOPRD1
SCHEMBL27747269 0.77 OPRD1 (0.38) CYP2B6PDE1CPDE1APDE1BYTHDC1
SCHEMBL11000408 0.76 NPC1 (0.42) CYP2B6PDE1CPDE1APDE1BOPRD1
SCHEMBL28192282 0.76 KDM4E (0.50) CYP2B6PDE1CPDE1APDE1BYTHDC1
SCHEMBL28786620 0.75 BRD4 (0.40) KDM4EBRD4PKMKDM4C
SCHEMBL28731285 0.75 BRD4 (0.40) KDM4EBRD4PKMKDM4C
SCHEMBL27726453 0.75 OPRD1 (0.40) CYP2B6PDE1CPDE1APDE1BYTHDC1
SCHEMBL5655701 0.74 KCNH2 (0.40) PDE1CPDE1APDE1BOPRD1CYP11B2

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
CN-113905787-A METTL3 inhibiting compounds 斯托姆治疗有限公司 2022-01-07 CN disclosed