SCHEMBL8514591

SCHEMBL8514591

N[C@H](CO)c1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.44
HTR2A P28223 1/20 0.43
CYP2A6 P11509 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALOX5 P09917 1/20 0.37
MAOA P21397 1/20 0.36
ALOX15 P16050 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
OGG1 O15527 1/20 0.35
ANPEP P15144 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
SCHEMBL1553955 1.00 DPP4 (0.44) DPP4HTR2ACYP2A6CYP1A2ALOX5
SCHEMBL1553953 1.00 DPP4 (0.44) DPP4HTR2ACYP2A6CYP1A2ALOX5
Hydrochloric Acid SCHEMBL17710303 0.98 DPP4 (0.43) DPP4HTR2ACYP2A6CYP1A2ALOX5
Hydrochloric Acid SCHEMBL18765813 0.98 DPP4 (0.43) DPP4HTR2ACYP2A6CYP1A2ALOX5
Hydrochloric Acid SCHEMBL15287423 0.98 DPP4 (0.43) DPP4HTR2ACYP2A6CYP1A2ALOX5
SCHEMBL1444985 0.87 ANPEP (0.41) CYP1A2ALOX15ANPEP
SCHEMBL30200359 0.85 DPP4 (0.36) DPP4HTR2ACYP1A2ALOX5ALDH1A1
SCHEMBL389437 0.82 DPP4 (0.42) DPP4HTR2ACYP2A6CYP1A2ALOX5
SCHEMBL22690052 0.82 DPP4 (0.42) DPP4HTR2ACYP2A6CYP1A2ALOX5
SCHEMBL389436 0.82 DPP4 (0.42) DPP4HTR2ACYP2A6CYP1A2ALOX5

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
WO-2025125295-A1 THIENO-INDOLE AMIDE DERIVATIVES AS PHGDH INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2025-06-19 WO disclosed
CN-114174245-B Synthesis method of non-racemized cyclohexene 巴斯夫公司 2024-05-10 CN disclosed
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
WO-2023239645-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
CN-116515782-A Amine dehydrogenase mutant and application thereof in chiral amine alcohol compound synthesis 中国科学院天津工业生物技术研究所 2023-08-01 CN disclosed
CN-114836486-B Method for synthesizing chiral beta-amino alcohol by enzyme catalysis 湖北大学 2023-05-12 CN disclosed
CN-115867554-A BRM targeting compounds and related methods of use 普莱鲁德疗法有限公司 2023-03-28 CN disclosed
US-20220281838-A1 N-METHYL, N-(6-(METHOXY)PYRIDAZIN-3-YL) AMINE DERIVATIVES AS AUTOTAXIN (ATX) MODULATORS FOR THETREATMENT OF INFLAMMATORY AIRWAY OR FIBROTIC DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-09-08 US disclosed
CN-114836486-A Method for synthesizing chiral beta-amino alcohol by enzyme catalysis 湖北大学 2022-08-02 CN disclosed
CN-114174245-A Synthetic method of non-racemic cyclohexene 巴斯夫公司 2022-03-11 CN disclosed
EP-3731869-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2020-11-04 EP disclosed
EP-3684366-A1 CRBN LIGANDS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2020-07-29 EP disclosed
WO-2019060693-A1 CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2019-03-28 WO disclosed
EP-2643313-B9 QUINAZOLINE CARBOXAMIDE AZETIDINES MERCK PATENT GMBH (DE) 2017-02-22 EP disclosed
EP-2643313-B1 QUINAZOLINE CARBOXAMIDE AZETIDINES MERCK PATENT GMBH (DE) 2016-06-29 EP disclosed
CN-103228649-B Quinazoline methane amide azetidine MERCK PATENT GMBH (DE) 2015-11-25 CN disclosed
US-8946247-B2 Quinazoline carboxamide azetidines MERCK PATENT GMBH (DE) 2015-02-03 US disclosed
EP-2643313-A1 QUINAZOLINE CARBOXAMIDE AZETIDINES Merck Patent GmbH (DE) 2013-10-02 EP disclosed
US-20130252942-A1 QUINAZOLINE CARBOXAMIDE AZETIDINES MERCK PATENT GMBH (DE) 2013-09-26 US disclosed
WO-2012069146-A1 QUINAZOLINE CARBOXAMIDE AZETIDINES MERCK PATENT GMBH (DE) 2012-05-31 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 (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-20220281838-A1 N-METHYL, N-(6-(METHOXY)PYRIDAZIN-3-YL) AMINE DERIVATIVES AS AUTOTAXIN (ATX) MODULATORS FOR THETREATMENT OF INFLAMMATORY AIRWAY OR FIBROTIC DISEASES ENPP2, MYT1, INMT DPP4 2806/4885HTR2A 491/4885CYP2A6 3357/4885
US-20130252942-A1 QUINAZOLINE CARBOXAMIDE AZETIDINES AZI2, NQO2, ABL1 DPP4 1055/4885HTR2A 446/4885CYP2A6 1219/4885

“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.