SCHEMBL9976608

SCHEMBL9976608

Cc1ccc(-c2c3nc(c(-c4ccc(C(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(c(-c5ccc(C(=O)O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.86

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.86
▸ CYCS P99999 4/20 0.83
▸ ABCG2 Q9UNQ0 1/20 0.55
▸ ENPP2 Q13822 1/20 0.52
▸ TERT O14746 4/20 0.52
▸ ALDH1A1 P00352 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ GLA P06280 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MAPK1 P28482 1/20 0.47
▸ MAP2K4 P45985 1/20 0.47
▸ MAPKAPK3 Q16644 1/20 0.47
▸ MAPK6 Q16659 1/20 0.47
▸ SRD5A2 P31213 1/20 0.45

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
SCHEMBL1977052 1.00 TOP1 (0.86) TOP1CYCSABCG2ENPP2TERT
SCHEMBL709532 0.93 TOP1 (1.00) TOP1CYCSABCG2ENPP2TERT
SCHEMBL29354037 0.93 TOP1 (1.00) TOP1CYCSABCG2ENPP2TERT
SCHEMBL30928977 0.91 TOP1 (0.97) TOP1CYCSABCG2ENPP2TERT
SCHEMBL31463636 0.91 TOP1 (0.97) TOP1CYCSABCG2ENPP2TERT
SCHEMBL31439152 0.91 TOP1 (0.97) TOP1CYCSABCG2ENPP2TERT
SCHEMBL17183606 0.91 TOP1 (0.97) TOP1CYCSABCG2ENPP2TERT
SCHEMBL19640853 0.91 CYCS (1.00) TOP1CYCSABCG2ENPP2TERT
SCHEMBL3047596 0.91 TOP1 (0.97) TOP1CYCSABCG2ENPP2TERT
SCHEMBL12842181 0.91 CYCS (0.97) TOP1CYCSABCG2ENPP2TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150118313-A1 ENHANCED FOLIC ACID FLUORESCENT MATERIAL, MULTIFLUORESCENT POROUS COMPOSITIONS OF MATTER AND POTENTIAL APPLICATIONS THEREOF NANOLOGICA AB (SE) 2015-04-30 — — US disclosed
US-20130058987-A1 ENHANCED FOLIC ACID FLUORESCENT MATERIAL, MULTIFLUORESCENT POROUS COMPOSITIONS OF MATTER AND POTENTIAL APPLICATIONS THEREOF NANOLOGICA AB (SE) 2013-03-07 — — US disclosed
US-20120157824-A1 MRI AND OPTICAL ASSAYS FOR PROTEASES NANOSCALE CORPORATION (US) 2012-06-21 — — US disclosed
US-20120157824-A1 MRI AND OPTICAL ASSAYS FOR PROTEASES NANOSCALE CORPORATION (US) 2012-06-21 — — 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-20150118313-A1 ENHANCED FOLIC ACID FLUORESCENT MATERIAL, MULTIFLUORESCENT POROUS COMPOSITIONS OF MATTER AND POTENTIAL APPLICATIONS THEREOF FOLR1, FOLR2, SLC19A1 TOP1 3035/4885CYCS 2941/4885ABCG2 35/4885
US-20120157824-A1 MRI AND OPTICAL ASSAYS FOR PROTEASES PREP, HPN, ADAM9 TOP1 3616/4885CYCS 4383/4885ABCG2 4124/4885
US-20130058987-A1 ENHANCED FOLIC ACID FLUORESCENT MATERIAL, MULTIFLUORESCENT POROUS COMPOSITIONS OF MATTER AND POTENTIAL APPLICATIONS THEREOF FOLR1, FOLR2, SLC19A1 TOP1 3035/4885CYCS 2941/4885ABCG2 35/4885

“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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