SCHEMBL12108184

SCHEMBL12108184

O=C(O)c1cn([C@@H](CO)c2ccccc2)c2cnc(Cc3cccc(Cl)c3F)cc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 2/20 0.53
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ CFD P00746 1/20 0.33
▸ METTL14 Q9HCE5 1/20 0.33
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ ADA P00813 1/20 0.32
▸ MAPK1 P28482 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ RORC P51449 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ CHRM1 P11229 1/20 0.31

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
SCHEMBL12108176 0.90 METTL3 (0.55) METTL3GAAHTTCFDMRGPRX4
SCHEMBL12108173 0.88 METTL3 (0.60) METTL3GAAHTTCFDMRGPRX4
SCHEMBL1301704 0.86 METTL3 (0.70) METTL3GAAHTTCFDMRGPRX4
SCHEMBL12108160 0.86 METTL3 (0.55) METTL3GAAHTTCFDMRGPRX4
SCHEMBL12108158 0.86 METTL3 (0.56) METTL3GAAHTTCFDMRGPRX4
SCHEMBL1045214 0.85 METTL3 (0.55) METTL3GAAHTTMETTL14MAPT
SCHEMBL1045212 0.85 METTL3 (0.55) METTL3GAAHTTMETTL14MAPT
SCHEMBL12108172 0.85 METTL3 (0.53) METTL3GAAHTTCFDMRGPRX4
SCHEMBL12108164 0.84 METTL3 (0.60) METTL3GAAHTTCFDMRGPRX4
SCHEMBL12108188 0.84 METTL3 (0.46) METTL3GAAHTTCFDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 — — US disclosed
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 — — US disclosed
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE AARDEA BIOSCIENCES, INC. (US) 2011-07-07 — — US disclosed
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE AARDEA BIOSCIENCES, INC. (US) 2011-07-07 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885GAA 176/4885HTT 4411/4885
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885GAA 176/4885HTT 4411/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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