SCHEMBL19153238

SCHEMBL19153238

Cc1cc2[nH]cnc(=O)c2cn1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.38
▸ UHRF1 Q96T88 1/20 0.35
▸ PARP1 P09874 3/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ TDO2 P48775 1/20 0.33
▸ PNP P00491 1/20 0.33
▸ IL5 P05113 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ PRNP P04156 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7657497 0.85 UHRF1 (0.35) MAPTUHRF1PARP1CHEK1PIM1
SCHEMBL29872244 0.78 KDM4E (0.35) MAPTPARP1CHEK1PIM1RPS6KA3
SCHEMBL18237575 0.77 KDM5B (0.33) PNP
SCHEMBL29872631 0.77 MAPT (0.41) MAPTPARP1TDO2
SCHEMBL22962863 0.77 PARP1 (0.41) MAPTPARP1CHEK1PIM1RPS6KA3
SCHEMBL29638516 0.74 PARP1 (0.54) PARP1CHEK1PIM1RPS6KA3MEN1
SCHEMBL13003705 0.74 PARP1 (0.54) PARP1CHEK1PIM1RPS6KA3MEN1
SCHEMBL25375705 0.73 PARP1 (0.38) MAPTPARP1CHEK1PIM1RPS6KA3
SCHEMBL30402730 0.73 PARP1 (0.38) MAPTPARP1CHEK1PIM1RPS6KA3
SCHEMBL19153714 0.73 ALDH1A1 (0.49) MAPTTDO2IL5KMT2AALDH1A1

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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 — — 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 (1 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT MAPT 1162/4885UHRF1 2152/4885PARP1 2195/4885

“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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