SCHEMBL682711

SCHEMBL682711

COc1cccn2nc(C)c(C(C)=O)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.40
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HTR1A P08908 2/20 0.38
▸ ADRA1D P25100 2/20 0.38
▸ ADRA1A P35348 2/20 0.38
▸ ADRA1B P35368 2/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.38
▸ TP53 P04637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL683860 0.87 ALDH1A1 (0.37) KMT2AMAPK1ALDH1A1HSD17B10L3MBTL1
SCHEMBL2961663 0.82 TP53 (0.37) GAAKMT2AMEN1MAPK1ALDH1A1
SCHEMBL7373297 0.81 POLB (0.39) KMT2AALDH1A1HSD17B10L3MBTL1TP53
SCHEMBL683558 0.80 THRB (0.44) KMT2AALDH1A1HSD17B10L3MBTL1TP53
SCHEMBL683499 0.79 POLB (0.38) KMT2AALDH1A1HSD17B10L3MBTL1TP53
SCHEMBL31131798 0.75 ADRA1A (0.39) HTR1AADRA1DADRA1AADRA1B
SCHEMBL683872 0.73 ALDH1A1 (0.59) GAAKMT2AMEN1ALDH1A1HTR1A
SCHEMBL5848990 0.70 ALDH1A1 (0.51) GAAKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL8800364 0.70 EPHB3 (0.36) GAAKMT2AMEN1MAPK1TP53
SCHEMBL19128307 0.69 MAP3K14 (0.34) GAAKMT2AALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 — — US disclosed
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 — — 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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF GAA 1899/4885KMT2A 1893/4885MEN1 1910/4885

“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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