SCHEMBL17747472

SCHEMBL17747472

COc1ccc(C(=O)c2sc3nc(C)c(C(=O)O)c(-c4ccc(Cl)cc4)c3c2N)cc1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 10/20 0.75
▸ ABCC1 P33527 4/20 0.65
▸ MAPT P10636 6/20 0.62
▸ ALDH1A1 P00352 5/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ HPGD P15428 4/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ CHRM4 P08173 2/20 0.55
▸ KDM4E B2RXH2 2/20 0.54
▸ HTT P42858 1/20 0.54
▸ GAA P10253 1/20 0.53

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
SCHEMBL17747435 0.95 ABCG2 (0.83) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747482 0.91 ABCG2 (0.77) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747465 0.91 ABCG2 (0.76) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747475 0.89 ABCG2 (0.73) ABCG2ABCC1MAPT
SCHEMBL17747502 0.89 ABCG2 (0.85) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747498 0.89 ABCG2 (0.73) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747437 0.87 ABCG2 (0.75) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747483 0.87 ABCG2 (0.73) ABCG2ABCC1MAPTALDH1A1MEN1
SCHEMBL17747432 0.87 ABCG2 (0.85) ABCG2ABCC1MAPTMEN1KMT2A
SCHEMBL17747445 0.86 ABCG2 (0.68) ABCG2ABCC1MAPTALDH1A1MEN1

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-9908893-B2 Thieno [2,3-b] pyridines as multidrug resistance modulators LATVIAN INSTITUTE OF ORGANIC SYNTHESIS (LV) 2018-03-06 — — US disclosed
US-20160137664-A1 THIENO [2,3-b] PYRIDINES AS MULTIDRUG RESISTANCE MODULATORS LATVIAN INSTITUTE OF ORGANIC SYNTHESIS (LV) 2016-05-19 — — 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-20160137664-A1 THIENO [2,3-b] PYRIDINES AS MULTIDRUG RESISTANCE MODULATORS ABCC1, ABCB1, MT-CO1 ABCG2 223/4885ABCC1 1/4885MAPT 4273/4885

“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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