SCHEMBL18188993

SCHEMBL18188993

COc1ccc(C=O)c(OC(=O)O)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ ERN1 O75460 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ SRC P12931 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 3/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ CYP1A1 P04798 2/20 0.43
▸ CYP1B1 Q16678 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TP53 P04637 1/20 0.43

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
SCHEMBL18188991 0.88 ABCG2 (0.50) ABCG2ERN1ALDH1A1SRCCA1
SCHEMBL11043755 0.85 ALDH1A1 (0.45) ABCG2ERN1ALDH1A1SRCNPC1
SCHEMBL31474876 0.84 ALDH1A1 (0.56) ABCG2ERN1ALDH1A1SRCCA1
SCHEMBL269268 0.84 ALDH1A1 (0.56) ABCG2ERN1ALDH1A1SRCCA1
SCHEMBL16048364 0.83 SRC (0.60) ERN1ALDH1A1SRCCA1CA2
Alcohol SCHEMBL28299718 0.79 ABCG2 (0.51) ABCG2ERN1ALDH1A1SRCCA1
SCHEMBL6901102 0.78 ABCG2 (0.46) ABCG2ERN1ALDH1A1CA1CA2
SCHEMBL2799192 0.78 KMT2A (0.52) ABCG2ERN1ALDH1A1SRCCA1
SCHEMBL29952661 0.78 KMT2A (0.52) ABCG2ERN1ALDH1A1SRCCA1
SCHEMBL18196756 0.78 CA1 (0.59) ERN1ALDH1A1SRCCA1CA2

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
EP-3288933-B1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUND FOR RES DEV (US) 2021-10-06 — — EP disclosed
US-10370328-B2 Oxindole compounds and pharmaceutical compositions thereof MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2019-08-06 — — US disclosed
US-20180134659-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2018-05-17 — — US disclosed
EP-3288933-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF Musc Foundation for Research Development (US) 2018-03-07 — — EP disclosed
WO-2016176420-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2016-11-03 — — WO 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 (2 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-10370328-B2 Oxindole compounds and pharmaceutical compositions thereof PARK7, OPRK1, COMT ABCG2 77/4885ERN1 3866/4885ALDH1A1 212/4885
US-20180134659-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF PARK7, OPRK1, COMT ABCG2 77/4885ERN1 3866/4885ALDH1A1 212/4885

“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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