SCHEMBL21491244

SCHEMBL21491244

CC(C)(C)OC(=O)N1CCCOCC1c1cc(Br)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 4/20 0.40
USP30 Q70CQ3 1/20 0.39
OPRK1 P41145 1/20 0.39
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 1/20 0.38
MALT1 Q9UDY8 1/20 0.36
POLB P06746 1/20 0.36
UCHL1 P09936 1/20 0.36
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL31472404 1.00 TSHR (0.40) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL29456491 0.92 TSHR (0.42) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL21491471 0.92 TSHR (0.42) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL29456500 0.92 TSHR (0.42) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL21491427 0.88 NR1H2 (0.42) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL31472390 0.88 NR1H2 (0.42) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL38652154 0.86 ALDH1A1 (0.44) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL21491445 0.86 OPRK1 (0.44) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL21491133 0.86 OPRK1 (0.40) TSHRLMNAKMT2AMEN1MAPT
SCHEMBL31472418 0.86 OPRK1 (0.40) TSHRLMNAKMT2AMEN1MAPT

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250188070-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2025-06-12 US disclosed
US-12195453-B2 Antiproliferation compounds and uses thereof MERCK PATENT GMBH (DE) 2025-01-14 US disclosed
EP-4043460-B1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2024-06-05 EP disclosed
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-05-18 US disclosed
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-05-18 US disclosed
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-05-18 US disclosed
US-11440907-B1 Antiproliferation compounds and uses thereof MERCK PATENT GMBH (DE) 2022-09-13 US disclosed
EP-4043460-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF Merck Patent GmbH (DE) 2022-08-17 EP disclosed
EP-4043460-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF Merck Patent GmbH (DE) 2022-08-17 EP disclosed
EP-3784666-B1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2022-03-16 EP disclosed
EP-3784666-B1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2022-03-16 EP disclosed
CN-112236428-A Antiproliferative compounds and uses thereof 默克专利股份有限公司 2021-01-15 CN disclosed
US-10815225-B2 Antiproliferation compounds and uses thereof MERCK PATENT GMBH (DE) 2020-10-27 US disclosed
US-10815225-B2 Antiproliferation compounds and uses thereof MERCK PATENT GMBH (DE) 2020-10-27 US disclosed
US-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-10-24 US disclosed
US-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-10-24 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 (6 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-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI TSHR 3810/4885LMNA 1520/4885KMT2A 2819/4885
US-12195453-B2 Antiproliferation compounds and uses thereof MKI67, MCL1, CCNI TSHR 3810/4885LMNA 1520/4885KMT2A 2819/4885
US-11440907-B1 Antiproliferation compounds and uses thereof MKI67, MCL1, CCNI TSHR 3810/4885LMNA 1520/4885KMT2A 2819/4885
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI TSHR 3810/4885LMNA 1520/4885KMT2A 2819/4885
US-10815225-B2 Antiproliferation compounds and uses thereof MKI67, MCL1, CCNI TSHR 3810/4885LMNA 1520/4885KMT2A 2819/4885
US-20250188070-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI TSHR 3810/4885LMNA 1520/4885KMT2A 2819/4885

“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.