SCHEMBL18009774

SCHEMBL18009774

CC(C)(C)OC(=O)N1CCc2cccc(I)c2C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.54
NR1H2 P55055 1/20 0.53
MAPK1 P28482 1/20 0.50
ABHD6 Q9BV23 1/20 0.46
DDB1 Q16531 2/20 0.46
CRBN Q96SW2 2/20 0.46
TMEM97 Q5BJF2 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
UCHL1 P09936 1/20 0.44
PRMT5 O14744 3/20 0.44
WDR77 Q9BQA1 3/20 0.44
NAMPT P43490 2/20 0.43
PARP1 P09874 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
PARP2 Q9UGN5 1/20 0.43
SCN9A Q15858 1/20 0.43
MAPT P10636 1/20 0.42
ADORA1 P30542 1/20 0.42
PDK4 Q16654 1/20 0.41
C5AR1 P21730 1/20 0.41

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
SCHEMBL30207825 1.00 ESR2 (0.54) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL16730890 0.90 ESR2 (0.54) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL19608875 0.86 ESR2 (0.56) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL3693657 0.85 ESR2 (0.59) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL30199091 0.85 ESR2 (0.59) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL29801280 0.84 ESR2 (0.54) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL20364333 0.84 ESR2 (0.54) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL29734640 0.84 ESR2 (0.54) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL4519564 0.84 NR1H2 (0.60) ESR2NR1H2MAPK1ABHD6DDB1
SCHEMBL29417735 0.84 ABHD6 (0.65) ESR2NR1H2MAPK1ABHD6DDB1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552826-B2 PRMT5 inhibitors MERCK SHARP & DOHME LLC (US) 2026-02-17 US disclosed
US-20210309687-A1 PRMT5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2021-10-07 US disclosed
EP-3464249-B1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2021-08-11 EP disclosed
EP-3464249-B1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2021-08-11 EP disclosed
EP-3833669-A1 PRMT5 INHIBITORS Merck Sharp & Dohme Corp. (US) 2021-06-16 EP disclosed
US-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2020-07-14 US disclosed
US-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2020-07-14 US disclosed
EP-3262057-B1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2020-04-15 EP disclosed
WO-2020033285-A1 PRMT5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-02-13 WO disclosed
US-10428104-B2 Substituted nucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2019-10-01 US disclosed
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2019-04-18 US disclosed
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2019-04-18 US disclosed
US-10220037-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2019-03-05 US disclosed
US-10220037-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2019-03-05 US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 US disclosed
WO-2016135582-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2016-09-01 WO disclosed
US-20160244475-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2016-08-25 US disclosed
US-20160244475-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2016-08-25 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 (8 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-10428104-B2 Substituted nucleoside derivatives useful as anticancer agents TYMP, NME1, DPYD ESR2 3672/4885NR1H2 3470/4885MAPK1 3190/4885
US-20160244475-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS TYMP, NME1, PNP ESR2 3795/4885NR1H2 3470/4885MAPK1 2497/4885
US-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents DUT, NCL, TYMP ESR2 2951/4885NR1H2 3021/4885MAPK1 3113/4885
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP ESR2 2951/4885NR1H2 3021/4885MAPK1 3113/4885
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP ESR2 2951/4885NR1H2 3021/4885MAPK1 3113/4885
US-10220037-B2 Substituted carbonucleoside derivatives useful as anticancer agents DUT, NCL, TYMP ESR2 2951/4885NR1H2 3021/4885MAPK1 3113/4885
US-20210309687-A1 PRMT5 INHIBITORS PRMT5, PRMT1, PRMT6 ESR2 2400/4885NR1H2 698/4885MAPK1 1660/4885
US-12552826-B2 PRMT5 inhibitors PRMT5, PRMT6, PRMT1 ESR2 2969/4885NR1H2 322/4885MAPK1 1824/4885

“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.