SCHEMBL18998863

SCHEMBL18998863

CCCOC(=O)c1ccc2c(c1)C(=O)N(c1ccc(N3C(=O)c4ccc(C(=O)OCCOC(=O)c5ccc(C(=O)OC)cc5)cc4C3=O)cc1)C2=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.76
▸ CA1 P00915 3/20 0.61
▸ CA2 P00918 3/20 0.61
▸ CA9 Q16790 3/20 0.61
▸ CA4 P22748 2/20 0.61
▸ LMNA P02545 2/20 0.60
▸ MET P08581 1/20 0.54
▸ CA12 O43570 3/20 0.53
▸ CA7 P43166 1/20 0.53
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ KDM4E B2RXH2 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ PLA2G1B P04054 1/20 0.50
▸ ATG4B Q9Y4P1 1/20 0.50
▸ MAPT P10636 3/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ PTGES O14684 1/20 0.47
▸ ATM Q13315 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
SCHEMBL18998864 0.94 ALDH1A1 (0.71) ALDH1A1CA1CA2CA9CA4
SCHEMBL18053290 0.87 CA1 (0.76) ALDH1A1CA1CA2CA9CA4
SCHEMBL18998862 0.86 CA1 (0.61) ALDH1A1CA1CA2CA9CA4
SCHEMBL16644575 0.82 ALDH1A1 (0.67) ALDH1A1CA1CA2CA9CA4
SCHEMBL19004800 0.81 CA9 (0.70) ALDH1A1CA1CA2CA9CA4
SCHEMBL17384135 0.81 ALDH1A1 (0.68) ALDH1A1CA1CA2CA9CA4
SCHEMBL19623055 0.81 CA9 (0.67) ALDH1A1CA1CA2CA9CA4
SCHEMBL18053289 0.81 ALDH1A1 (0.64) ALDH1A1CA1CA2CA9CA4
SCHEMBL18998861 0.81 CA1 (0.57) ALDH1A1CA1CA2CA9CA4
SCHEMBL1618305 0.79 ALDH1A1 (0.70) ALDH1A1CA1CA2CA9CA4

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-20170174831-A1 COPOLYESTERIMIDES COMPRISING BIS(2-HYDROXYALKYL)-2,2'-(1,4-PHENYLENE)BIS(1,3-DIOXOISOINDOLINE-5-CARBOXYLATE) AND ARTICLES MADE THEREFROM DUPONT TEIJIN FILMS U.S. LIMITED PARTNERSHIP (US) 2017-06-22 — — 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-20170174831-A1 COPOLYESTERIMIDES COMPRISING BIS(2-HYDROXYALKYL)-2,2'-(1,4-PHENYLENE)BIS(1,3-DIOXOISOINDOLINE-5-CARBOXYLATE) AND ARTICLES MADE THEREFROM PUF60, PDS5A, DDT ALDH1A1 135/4885CA1 1896/4885CA2 1965/4885

“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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