SCHEMBL20158042

SCHEMBL20158042

COc1cc(Br)c(Cl)cc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HTR2A P28223 2/20 0.39
TAAR1 Q96RJ0 2/20 0.39
HTR2C P28335 1/20 0.39
PRKDC P78527 1/20 0.38
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
SLC6A4 P31645 1/20 0.37
KCNH2 Q12809 1/20 0.37
NPC1 O15118 2/20 0.36
GAA P10253 1/20 0.36
PTGES2 Q9H7Z7 1/20 0.36
RAB9A P51151 2/20 0.36
PPOX P50336 1/20 0.36
AHR P35869 2/20 0.35
PTGS2 P35354 2/20 0.35
ALOX5 P09917 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
SCHEMBL22125243 0.92 TAAR1 (0.39) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL31118436 0.83 NPC1 (0.45) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL1223997 0.83 NPC1 (0.45) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL19088274 0.82 HTR2A (0.44) MAPTNPSR1HTR2ATAAR1HTR2C
SCHEMBL29587335 0.82 PRKDC (0.48) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL3838882 0.80 POLB (0.46) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL263749 0.80 NPC1 (0.56) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL12811595 0.80 HTR2A (0.52) POLBL3MBTL1MAPTNPSR1HTR2A
SCHEMBL19756672 0.80 HTR2A (0.47) MAPTNPSR1HTR2ATAAR1HTR2C
SCHEMBL28788044 0.80 HTR2A (0.47) POLBL3MBTL1MAPTNPSR1HTR2A

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-4696681-A1 HERBICIDAL THIOCARBAMATES CARRYING AN ISOXAZOLIN-SUBSTITUTED PHENYL RING BASF SE (DE) 2026-02-18 EP disclosed
US-12528828-B2 Substituted pyrido[4,3-d]pyrimidines as KRAS modulators ALTEROME THERAPEUTICS, INC. (US) 2026-01-20 US disclosed
US-20250346610-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS ALTEROME THERAPEUTICS INC (US) 2025-11-13 US disclosed
US-12466842-B2 Substituted pyrido [4,3-d]pyrimidines as KRAS modulators ALTEROME THERAPEUTICS, INC. (US) 2025-11-11 US disclosed
US-20250296936-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-09-25 US disclosed
US-20250282799-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS ALTEROME THERAPEUTICS, INC. 2025-09-11 US disclosed
US-20250276979-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-09-04 US disclosed
US-20250179093-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. 2025-06-05 US disclosed
WO-2025064542-A1 KRAS MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2025-03-27 WO disclosed
US-20240209001-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS Chiesi Farmaceutici S.p. A. (IT) 2024-06-27 US disclosed
EP-4308244-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-01-24 EP disclosed
CN-117098765-A Heterocyclic derivatives as Janus kinase inhibitors 奇斯药制品公司 2023-11-21 CN disclosed
WO-2022194781-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2022-09-22 WO disclosed
US-20190284192-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF SHANDONG LUOXIN PHARMACEUTICAL GROUP STOCK CO., LTD. (CN) 2019-09-19 US disclosed
EP-3539960-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) 2019-09-18 EP disclosed
WO-2018086605-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF 山东罗欣药业集团股份有限公司 2018-05-17 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 (9 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-20250179093-A1 KRAS MODULATORS KRAS, NRAS, HRAS POLB 1197/4885L3MBTL1 1865/4885MAPT 3784/4885
US-20250346610-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS KRAS, NRAS, HRAS POLB 393/4885L3MBTL1 2548/4885MAPT 3604/4885
US-12466842-B2 Substituted pyrido [4,3-d]pyrimidines as KRAS modulators KRAS, NRAS, HRAS POLB 393/4885L3MBTL1 2548/4885MAPT 3604/4885
US-20250276979-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE POLB 1288/4885L3MBTL1 4026/4885MAPT 2197/4885
US-20190284192-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF MYC, BRD1, BRD3 POLB 1116/4885L3MBTL1 873/4885MAPT 237/4885
US-20250296936-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE POLB 1307/4885L3MBTL1 4074/4885MAPT 2082/4885
US-20250282799-A1 SUBSTITUTED PYRIDO[4,3-d]PYRIMIDINES AS KRAS MODULATORS KRAS, NRAS, HRAS POLB 393/4885L3MBTL1 2548/4885MAPT 3604/4885
US-12528828-B2 Substituted pyrido[4,3-d]pyrimidines as KRAS modulators KRAS, NRAS, HRAS POLB 281/4885L3MBTL1 1806/4885MAPT 3501/4885
US-20240209001-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS TYK2, JAK3, JAK1 POLB 3649/4885L3MBTL1 4246/4885MAPT 3444/4885

“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.