SCHEMBL2111428

SCHEMBL2111428

CCSc1ccc(Br)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.37
RCOR1 Q9UKL0 1/20 0.37
SLC6A4 P31645 9/20 0.35
MAOA P21397 1/20 0.35
KCNH2 Q12809 2/20 0.34
KDM1B Q8NB78 1/20 0.34
IDO1 P14902 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL29488670 1.00 KDM1A (0.37) KDM1ARCOR1SLC6A4MAOAKCNH2
SCHEMBL15067807 0.84 IDO1 (0.40) SLC6A4MAOAIDO1HTR2AHTR2C
SCHEMBL1146608 0.81 SLC6A4 (0.38) SLC6A4MAOAHTR2AHTR2CHTR2B
SCHEMBL709839 0.78 MAPT (0.40) SLC6A4MAOAHTR2AHTR2CHTR2B
SCHEMBL29504578 0.77 KDM1A (0.37) KDM1ARCOR1KCNH2KDM1B
SCHEMBL387740 0.77 KDM1A (0.37) KDM1ARCOR1KCNH2KDM1B
SCHEMBL17543247 0.77 KDM1A (0.32) KDM1ASLC6A4MAOAKDM1B
SCHEMBL30714184 0.77 MAOA (0.33) KDM1ARCOR1SLC6A4MAOACYP2C9
SCHEMBL16048360 0.77 MAOA (0.33) KDM1ARCOR1SLC6A4MAOACYP2C9
SCHEMBL23243036 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304572-A1 HETEROCYCLIC GLP-1R AGONISTS BIOMEA FUSION, INC. 2025-10-02 US disclosed
US-12291529-B2 Heterocyclic GLP-1 agonists GASHERBRUM BIO, INC. (US) 2025-05-06 US disclosed
US-20240376105-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2024-11-14 US disclosed
US-20240327404-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO INC (US) 2024-10-03 US disclosed
EP-3939974-A1 MODULATORS OF ROR-GAMMA Vitae Pharmaceuticals, LLC (US) 2022-01-19 EP disclosed
WO-2022008911-A1 BENZODIAZEPINE DERIVATIVES USEFUL IN TREATING A RESPIRATORY SYNCYTIAL VIRUS INFECTION ReViral Limited (GB) 2022-01-13 WO disclosed
EP-3408268-B1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS LLC (US) 2021-08-04 EP disclosed
US-20210094940-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2021-04-01 US disclosed
US-10829481-B2 Benzimidazole derivatives as modulators of ROR-gamma VITAE PHARMACEUTICALS, LLC (US) 2020-11-10 US disclosed
US-20190352286-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2019-11-21 US disclosed
EP-3408268-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA Vitae Pharmaceuticals, Inc. (US) 2018-12-05 EP disclosed
WO-2017132432-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, INC. (US) 2017-08-03 WO disclosed
EP-1611091-B1 Substituted phenylalkanoic acid derivatives and their use for respiratory disease treatment ASTRAZENECA AB (SE) 2014-10-29 EP disclosed
US-8158820-B2 Compounds ASTRAZENECA AB (SE) 2012-04-17 US disclosed
US-20110166117-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-07-07 US disclosed
US-20060264435-A1 Novel compounds ASTRAZENECA AB (SE) 2006-11-23 US disclosed
EP-1611091-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2006-01-04 EP disclosed
WO-2004089885-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2004-10-21 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-20250304572-A1 HETEROCYCLIC GLP-1R AGONISTS GLP1R, GPR119, GIPR KDM1A 4083/4885RCOR1 3533/4885SLC6A4 2326/4885
US-20190352286-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA RORB, RORC, RORA KDM1A 2327/4885RCOR1 736/4885SLC6A4 4690/4885
US-10829481-B2 Benzimidazole derivatives as modulators of ROR-gamma RORB, RORC, RORA KDM1A 1774/4885RCOR1 1110/4885SLC6A4 4744/4885
US-20240376105-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, IAPP KDM1A 2995/4885RCOR1 3693/4885SLC6A4 933/4885
US-20110166117-A1 Novel Compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 KDM1A 1180/4885RCOR1 3565/4885SLC6A4 458/4885
US-20060264435-A1 Novel compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 KDM1A 1180/4885RCOR1 3565/4885SLC6A4 458/4885
US-12291529-B2 Heterocyclic GLP-1 agonists GLP1R, GIPR, IAPP KDM1A 2995/4885RCOR1 3693/4885SLC6A4 933/4885
US-20210094940-A1 MODULATORS OF ROR-GAMMA RORC, RORB, RORA KDM1A 2864/4885RCOR1 583/4885SLC6A4 4810/4885
US-20240327404-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, IAPP KDM1A 2995/4885RCOR1 3693/4885SLC6A4 933/4885

“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.