SCHEMBL346449

SCHEMBL346449

CCc1ccc(C=C2SC(=O)N(CCCCCCNC(=O)CCCCCNC(=O)OC(C)(C)C)C2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 9/20 0.69
▸ NCOA1 Q15788 1/20 0.53
▸ NCOA3 Q9Y6Q9 1/20 0.53
▸ PPARG P37231 1/20 0.49
▸ NPC1 O15118 1/20 0.48
▸ PTPN7 P35236 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ PTPN12 Q05209 1/20 0.47
▸ GPR35 Q9HC97 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ PTPN22 Q9Y2R2 1/20 0.47
▸ GPR55 Q9Y2T6 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAX P61244 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
SCHEMBL346448 1.00 MYC (0.69) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL346014 0.95 MYC (0.77) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL346013 0.95 MYC (0.77) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL346075 0.94 MYC (0.75) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL346076 0.94 MYC (0.75) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL346080 0.92 MYC (0.70) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL346081 0.92 MYC (0.70) MYCNCOA1NCOA3PPARGNPC1
SCHEMBL17934500 0.87 MYC (0.64) MYCPPARGNPC1RAB9AALDH1A1
SCHEMBL344436 0.85 MYC (0.61) MYCPPARGNPC1RAB9APOLB
SCHEMBL344437 0.85 MYC (0.61) MYCPPARGNPC1RAB9APOLB

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-8637556-B2 Linked Myc-max small molecule inhibitors University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2014-01-28 — — US disclosed
US-20120015989-A1 LINKED MYC-MAX SMALL MOLECULE INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2012-01-19 — — 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-20120015989-A1 LINKED MYC-MAX SMALL MOLECULE INHIBITORS MYC, MAX, MYCBP MYC 1/4885NCOA1 734/4885NCOA3 866/4885

“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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