SCHEMBL18100940

SCHEMBL18100940

Cc1ccc(Nc2cccc(-c3c(C)nc4ncccn34)n2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 11/20 0.65
▸ MAPT P10636 10/20 0.65
▸ ALDH1A1 P00352 8/20 0.65
▸ KDM4E B2RXH2 5/20 0.65
▸ LMNA P02545 4/20 0.65
▸ HPGD P15428 3/20 0.65
▸ RAB9A P51151 2/20 0.65
▸ ALOX12 P18054 2/20 0.65
▸ CYP1A2 P05177 1/20 0.65
▸ CYP3A4 P08684 1/20 0.65
▸ CYP2D6 P10635 1/20 0.65
▸ CYP2C19 P33261 1/20 0.65
▸ MAPK1 P28482 4/20 0.55
▸ HTT P42858 3/20 0.55
▸ PKM P14618 2/20 0.53
▸ POLB P06746 1/20 0.53
▸ KMT2A Q03164 6/20 0.52
▸ MEN1 O00255 4/20 0.52
▸ L3MBTL1 Q9Y468 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52

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
SCHEMBL1684656 0.83 MAPT (0.65) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL1684711 0.79 MAPT (1.00) GAAMAPTALDH1A1KDM4ELMNA
Bromide SCHEMBL18040788 0.78 MAPT (0.98) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL18100941 0.76 MAPT (0.50) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL16747972 0.75 PKM (0.53) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL18100931 0.75 MAPT (0.50) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL14054033 0.75 ALDH1A1 (0.56) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL1684749 0.74 CDK2 (0.58) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL1684728 0.74 CDK2 (0.58) GAAMAPTALDH1A1KDM4ELMNA
SCHEMBL16740047 0.73 GAA (0.45) GAAMAPTALDH1A1KDM4ELMNA

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-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 — — 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-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS BMI1, BAZ2A, BAZ2B GAA 4374/4885MAPT 4561/4885ALDH1A1 1727/4885

“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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