SCHEMBL5134290

SCHEMBL5134290

COc1ccc(Nc2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(Nc4ccc(OC)cc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1.[Zn]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.46
▸ KDM1A O60341 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ RAD52 P43351 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ ABCG2 Q9UNQ0 2/20 0.42
▸ MAPT P10636 4/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ GAA P10253 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ ALOX5 P09917 1/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ TERT O14746 2/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ ALDH1A1 P00352 2/20 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
SCHEMBL5134837 0.88 STAT3 (0.48) ABCG2TERTSTAT3STAT1TOP1
SCHEMBL5013009 0.86 STAT3 (0.49) ABCG2TERTSTAT3STAT1TOP1
SCHEMBL5135317 0.81 ABCG2 (0.41) KDM1AABCG2TERTSTAT3STAT1
SCHEMBL949511 0.79 TERT (0.57) ABCG2MAPTRAB9ASMN1; SMN2TERT
SCHEMBL29414382 0.79 TERT (0.57) ABCG2MAPTRAB9ASMN1; SMN2TERT
SCHEMBL5134205 0.78 STAT3 (0.43) ABCG2TERTSTAT3STAT1TOP1
SCHEMBL2338257 0.78 TERT (0.55) ABCG2MAPTRAB9ASMN1; SMN2TERT
SCHEMBL8430292 0.78 TERT (0.55) ABCG2MAPTRAB9ASMN1; SMN2TERT
SCHEMBL20856304 0.78 TERT (0.59) ABCG2MAPTRAB9ASMN1; SMN2TERT
SCHEMBL22265228 0.78 TERT (0.55) ABCG2MAPTRAB9ASMN1; SMN2TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7417142-B2 Chiral porphyrins, chiral metalloporphyrins, and methods for synthesis of the same THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION, INC. (US) 2008-08-26 — — US disclosed
US-20060030718-A1 Cobalt-based catalysts for the cyclization of alkenes UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2006-02-09 — — US disclosed
US-6951935-B2 Heteroatom-substituted porphyrins and methods for synthesis of same UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2005-10-04 — — US disclosed
US-20050124596-A1 Chiral porphyrins, chiral metalloporphyrins, and methods for synthesis of the same UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2005-06-09 — — US disclosed
US-20030236400-A1 Heteroatom-substituted porphyrins and methods for synthesis of same UNIVERSITY OF TENNESSEE RESEARCH CORPORATION 2003-12-25 — — 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 (3 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-20060030718-A1 Cobalt-based catalysts for the cyclization of alkenes PPOX, HCCS, ICOSLG KMT2A 1748/4885KDM1A 1679/4885POLB 1754/4885
US-20030236400-A1 Heteroatom-substituted porphyrins and methods for synthesis of same PPOX, HMBS, UROD KMT2A 1103/4885KDM1A 3116/4885POLB 1367/4885
US-20050124596-A1 Chiral porphyrins, chiral metalloporphyrins, and methods for synthesis of the same PPOX, PPIF, HMBS KMT2A 2709/4885KDM1A 3012/4885POLB 1490/4885

“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.

Send feedback