SCHEMBL20816043

SCHEMBL20816043

COC(=O)c1cc(-c2c[nH]cc2C(=O)OCc2ccc(F)cc2)cn1S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ L3MBTL1 Q9Y468 4/20 0.40
▸ LMNA P02545 4/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ DHODH Q02127 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ ERBB2 P04626 1/20 0.35

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
SCHEMBL25015538 0.91 OPRM1 (0.57) OPRM1OPRD1L3MBTL1LMNAKMT2A
SCHEMBL20816040 0.83 OPRM1 (0.48) OPRM1OPRD1L3MBTL1LMNAKMT2A
SCHEMBL23484064 0.82 OPRM1 (0.41) OPRM1OPRD1L3MBTL1LMNAKMT2A
SCHEMBL20816038 0.73 OPRM1 (0.85) OPRM1OPRD1NPC1RAB9AL3MBTL1
SCHEMBL20816036 0.70 MET (0.43) NPC1RAB9ALMNAKMT2AMAPT
SCHEMBL10125216 0.70 POLB (0.45) L3MBTL1LMNAKMT2AMAPTKDM4E
SCHEMBL6828202 0.69 MAPT (0.46) OPRM1OPRD1L3MBTL1LMNAALDH1A1
SCHEMBL6828215 0.69 MAPT (0.51) OPRM1OPRD1L3MBTL1LMNASMN1; SMN2
SCHEMBL17973534 0.68 CYP2C9 (0.42) L3MBTL1LMNAKMT2AMAPTKDM4E
SCHEMBL1719650 0.67 IKBKB (0.48) —

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-10577371-B2 Small molecule histone methyltransferase SUV39H1 inhibitor and uses thereof AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2020-03-03 — — US disclosed
US-20190084987-A1 Small Molecule Histone Methyltransferase SUV39H1 Inhibitor and Uses Thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-03-21 — — 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 (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-10577371-B2 Small molecule histone methyltransferase SUV39H1 inhibitor and uses thereof SUV39H2, SUV39H1, EZH1 OPRM1 4500/4885OPRD1 4790/4885NPC1 3423/4885
US-20190084987-A1 Small Molecule Histone Methyltransferase SUV39H1 Inhibitor and Uses Thereof SUV39H2, SUV39H1, EZH1 OPRM1 4500/4885OPRD1 4790/4885NPC1 3423/4885

“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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