SCHEMBL10036089

SCHEMBL10036089

C=CCN1C(=O)/C(=C2/SC=C(C)N2CCC(=O)O)SC1=S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.46
▸ MEN1 O00255 6/20 0.46
▸ POLB P06746 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MMP13 P45452 1/20 0.43
▸ MAPT P10636 5/20 0.41
▸ NCOA3 Q9Y6Q9 3/20 0.41
▸ MITF O75030 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ CISD1 Q9NZ45 2/20 0.41
▸ MAOA P21397 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL10036087 0.84 ALDH1A1 (0.51) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL1773565 0.84 KMT2A (0.60) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL10036086 0.77 MEN1 (0.72) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL11878882 0.75 KMT2A (0.48) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL11878875 0.75 KMT2A (0.48) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL14273144 0.72 KMT2A (0.60) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL9054686 0.68 MEN1 (0.60) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL9054683 0.68 MEN1 (0.60) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL11319531 0.67 KMT2A (0.57) KMT2AMEN1POLBALDH1A1HSD17B10
SCHEMBL11319535 0.67 KMT2A (0.57) KMT2AMEN1POLBALDH1A1HSD17B10

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-20120035187-A1 ANTI-NEURODEGENERATIVE DISEASE AGENT KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2012-02-09 — — US disclosed
US-20120035187-A1 ANTI-NEURODEGENERATIVE DISEASE AGENT KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2012-02-09 — — 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-20120035187-A1 ANTI-NEURODEGENERATIVE DISEASE AGENT SNCA, PSEN1, CDR2 KMT2A 2624/4885MEN1 2218/4885POLB 2015/4885

“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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