SCHEMBL1301914

SCHEMBL1301914

COc1nc2c(cc1NCCc1cccc(Cl)c1)c(=O)c(C(=O)O)cn2[C@H](CO)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.45
▸ ADORA1 P30542 2/20 0.37
▸ ADRB1 P08588 5/20 0.36
▸ ADRB3 P13945 5/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ APEX1 P27695 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ CSNK2A2 P19784 2/20 0.34
▸ CSNK2A1 P68400 2/20 0.34
▸ EGFR P00533 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ JAK3 P52333 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
SCHEMBL1301916 1.00 METTL3 (0.45) METTL3ADORA1ADRB1ADRB3MAOA
SCHEMBL1301419 0.92 METTL3 (0.46) METTL3APEX1KMT2AMEN1MAPT
SCHEMBL1301424 0.92 METTL3 (0.46) METTL3APEX1KMT2AMEN1MAPT
SCHEMBL1300908 0.87 METTL3 (0.42) METTL3KMT2AGSK3BMAPT
SCHEMBL1300902 0.87 METTL3 (0.42) METTL3KMT2AGSK3BMAPT
SCHEMBL1300646 0.85 METTL3 (0.44) METTL3KMT2AMEN1GSK3B
SCHEMBL1300641 0.85 METTL3 (0.44) METTL3KMT2AMEN1GSK3B
SCHEMBL1300784 0.85 METTL3 (0.43) METTL3MAPT
SCHEMBL1300778 0.85 METTL3 (0.43) METTL3MAPT
SCHEMBL1302316 0.84 METTL3 (0.46) METTL3ADORA1KMT2AGSK3BMAPT

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 3 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

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 2709/4885ADORA1 4124/4885ADRB1 4448/4885
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885ADORA1 4124/4885ADRB1 4448/4885

“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.

Send feedback