SCHEMBL20074738

SCHEMBL20074738

CC(C#N)C(=O)c1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
GSK3B P49841 3/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
LMNA P02545 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TNNI3 P19429 1/20 0.41
TNNT2 P45379 1/20 0.41
TNNC1 P63316 1/20 0.41
ALDH1A1 P00352 2/20 0.40
ALOX5 P09917 1/20 0.40
RECQL P46063 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL24114905 0.82 SLC6A3 (0.49) SLC6A2SLC6A4SLC6A3CES2CES1
SCHEMBL28003479 0.81 CES2 (0.45) SLC6A2SLC6A4SLC6A3CES2CES1
SCHEMBL20075576 0.81 LMNA (0.51) SLC6A2SLC6A3CES2CES1GSK3B
SCHEMBL1143569 0.81 CES2 (0.45) CES2CES1GSK3BCA1CA2
SCHEMBL2304365 0.81 GSK3B (0.61) SLC6A3GSK3BCA1CA2MEN1
SCHEMBL741168 0.80 PGR (0.47) SLC6A2SLC6A3CES2CES1LMNA
SCHEMBL28318760 0.78 HSD17B10 (0.38) SLC6A2SLC6A4SLC6A3GSK3BLMNA
SCHEMBL20075197 0.78 SMN1; SMN2 (0.41) SLC6A2SLC6A4SLC6A3CES2CES1
SCHEMBL2090053 0.78 CES2 (0.52) SLC6A2SLC6A4SLC6A3CES2CES1
SCHEMBL727222 0.77 CES2 (0.54) SLC6A2SLC6A4SLC6A3CES2CES1

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
EP-4720053-A1 LACTAM PESTICIDAL COMPOUNDS BASF SE (DE) 2026-04-08 EP disclosed
CN-119894870-A Azole pesticidal compounds 巴斯夫欧洲公司 2025-04-25 CN disclosed
WO-2024240859-A1 LACTAM PESTICIDAL COMPOUNDS BASF SE (DE) 2024-11-28 WO disclosed
US-20230065629-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2023-03-02 US disclosed
US-11208400-B2 Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof BAYER AKTIENGESELLSCHAFT (DE) 2021-12-28 US disclosed
US-11208400-B2 Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof BAYER AKTIENGESELLSCHAFT (DE) 2021-12-28 US disclosed
EP-3526212-B1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AG (DE) 2021-12-22 EP disclosed
EP-3526212-B1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AG (DE) 2021-12-22 EP disclosed
CN-113166070-A Pesticidal compounds 巴斯夫欧洲公司 2021-07-23 CN disclosed
EP-3643705-A1 PESTICIDAL COMPOUNDS BASF SE (DE) 2020-04-29 EP disclosed
US-20200055842-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2020-02-20 US disclosed
US-20200055842-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2020-02-20 US disclosed
CN-110191884-A Substituted 6- (1H-pyrazol-1-yl) pyrimidine-4-amine derivatives and uses thereof 拜耳公司 2019-08-30 CN disclosed
EP-3526212-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF Bayer Aktiengesellschaft (DE) 2019-08-21 EP disclosed
WO-2018069222-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-04-19 WO disclosed
WO-2018069222-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-04-19 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 (3 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-11208400-B2 Substituted 6-(1H-pyrazol-1-yl)pyrimidin-4-amine derivatives and uses thereof REN, ATP6V1B1, GLS SLC6A2 2672/4885SLC6A4 2216/4885SLC6A3 3291/4885
US-20200055842-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF REN, ATP6V1B1, GLS SLC6A2 2672/4885SLC6A4 2216/4885SLC6A3 3291/4885
US-20230065629-A1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF REN, ATP6V1B1, GLS SLC6A2 2672/4885SLC6A4 2216/4885SLC6A3 3291/4885

“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.