SCHEMBL21381604

SCHEMBL21381604

CCOC(=O)C1(c2cccc(Br)n2)CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
ALOX5 P09917 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
OPRM1 P35372 7/20 0.40
NPSR1 Q6W5P4 1/20 0.40
OPRD1 P41143 3/20 0.40
OPRK1 P41145 3/20 0.40
SLC22A1 O15245 1/20 0.40
SLC6A4 P31645 1/20 0.40
ADRA1A P35348 1/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.36

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
SCHEMBL30416644 1.00 ALDH1A1 (0.42) ALDH1A1ALOX5LMNATSHRCYP2C19
SCHEMBL24618229 0.91 OPRM1 (0.45) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL31114026 0.80 ALDH1A1 (0.46) ALDH1A1ALOX5LMNATSHRCYP2C19
SCHEMBL21431232 0.79 ALDH1A1 (0.43) ALDH1A1ALOX5LMNATSHRCYP2C19
SCHEMBL14239619 0.78 TSHR (0.42) TSHROPRM1OPRD1OPRK1SLC22A1
SCHEMBL21392093 0.77 CTPS1 (0.40) ALDH1A1ALOX5NPSR1
SCHEMBL30725706 0.77 CTPS1 (0.40) ALDH1A1ALOX5NPSR1
SCHEMBL21410167 0.77 ALOX5 (0.40) ALDH1A1ALOX5LMNATSHRCYP2C19
SCHEMBL7807438 0.76 ALDH1A1 (0.51) ALDH1A1ALOX5LMNATSHRCYP2C19
SCHEMBL30633571 0.76 RAB9A (0.36) ALDH1A1LMNACYP1A2

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-20250282756-A1 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors STEP PHARMA S.A.S. (FR) 2025-09-11 US disclosed
US-12371419-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors STEP PHARMA S.A.S. (FR) 2025-07-29 US disclosed
US-20250066324-A1 AMINOPYRIMIDINE/PYRAZINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2025-02-27 US disclosed
US-11987573-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors STEP PHARMA S.A.S. (FR) 2024-05-21 US disclosed
CN-111868051-B Aminopyrimidine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2024-04-09 CN disclosed
EP-3768674-B1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S A S (FR) 2024-01-03 EP disclosed
CN-112839938-B Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2023-07-07 CN disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 US disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 US disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 US disclosed
US-20210387965-A1 Compounds STEP PHARMA S.A.S. (FR) 2021-12-16 US disclosed
CN-112839938-A Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2021-05-25 CN disclosed
US-20210024507-A1 Compounds STEP PHARMA S A S (FR) 2021-01-28 US disclosed
US-20210024507-A1 Compounds STEP PHARMA S A S (FR) 2021-01-28 US disclosed
EP-3768674-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS Step Pharma S.A.S. (FR) 2021-01-27 EP disclosed
CN-111868051-A Aminopyrimidine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2020-10-30 CN disclosed
WO-2019179652-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2019-09-26 WO disclosed
WO-2019179652-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2019-09-26 WO disclosed
WO-2019180244-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2019-09-26 WO disclosed
WO-2019180244-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2019-09-26 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 (7 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-12371419-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors CTPS1, CTPS2, TYMS ALDH1A1 2030/4885ALOX5 4096/4885LMNA 4409/4885
US-20250282756-A1 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors CTPS1, CTPS2, TYMS ALDH1A1 1956/4885ALOX5 4177/4885LMNA 4396/4885
US-20250066324-A1 AMINOPYRIMIDINE/PYRAZINE DERIVATIVES AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS ALDH1A1 2030/4885ALOX5 4096/4885LMNA 4409/4885
US-20210024507-A1 Compounds CYP1A1, UGT1A1, CYP1A2 ALDH1A1 166/4885ALOX5 2571/4885LMNA 1782/4885
US-20230192673-A1 Compounds CYP1A1, UGT1A1, CYP1A2 ALDH1A1 166/4885ALOX5 2571/4885LMNA 1782/4885
US-20210387965-A1 Compounds CYP1A1, UGT1A1, CYP1B1 ALDH1A1 189/4885ALOX5 2430/4885LMNA 1780/4885
US-11987573-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors CTPS1, CTPS2, TYMS ALDH1A1 2030/4885ALOX5 4096/4885LMNA 4409/4885

“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.