SCHEMBL6045162

SCHEMBL6045162

Cc1cc(C)c(N2C(=O)c3ccc(C(=O)Nc4cc(C(=O)O)cc(C(=O)O)c4)cc3C2=O)c(C)c1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.58
▸ KMT2A Q03164 4/20 0.58
▸ RAB9A P51151 3/20 0.56
▸ POLB P06746 1/20 0.51
▸ ENPP2 Q13822 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ PTPN7 P35236 1/20 0.48
▸ PTPN22 Q9Y2R2 1/20 0.48
▸ FABP1 P07148 1/20 0.47
▸ P2RY14 Q15391 1/20 0.47
▸ CA12 O43570 3/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ HPSE Q9Y251 1/20 0.47
▸ CA7 P43166 2/20 0.47
▸ CA4 P22748 1/20 0.47
▸ NPC1 O15118 1/20 0.46

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
SCHEMBL1306542 0.76 CA1 (0.64) MEN1KMT2ARAB9APOLBENPP2
SCHEMBL1250713 0.75 KMT2A (0.60) MEN1KMT2ARAB9APOLBNPSR1
SCHEMBL7231980 0.75 P2RY14 (0.75) MEN1KMT2ARAB9APOLBPKM
SCHEMBL3502682 0.74 ALDH1A1 (0.75) MEN1KMT2ARAB9APOLBNPC1
SCHEMBL1250706 0.74 ANPEP (0.66) MEN1KMT2APOLBNPSR1CA12
SCHEMBL15248673 0.72 NPSR1 (0.49) MEN1KMT2APOLBNPSR1L3MBTL1
SCHEMBL24236725 0.72 MEN1 (0.61) MEN1KMT2ARAB9APOLBNPSR1
SCHEMBL16270607 0.72 P2RY14 (0.75) MEN1KMT2ARAB9APOLBPKM
SCHEMBL19189821 0.71 L3MBTL1 (0.81) MEN1KMT2ARAB9APOLBPKM
SCHEMBL15094713 0.71 L3MBTL1 (0.64) MEN1KMT2ARAB9APOLBPKM

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-20060004085-A1 Inhibitors of the S100-p53 protein-protein interaction and method of inhibiting cancer employing the same UNIVERSITY OF MARYLAND , BALTIMORE 2006-01-05 — — 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-20060004085-A1 Inhibitors of the S100-p53 protein-protein interaction and method of inhibiting cancer employing the same TP53, S100P, S100A4 MEN1 3359/4885KMT2A 4280/4885RAB9A 3367/4885

“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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