SCHEMBL21831869

SCHEMBL21831869

CC(Br)c1ccc(Br)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.36
KCNH2 Q12809 2/20 0.36
KDM1B Q8NB78 1/20 0.36
SLC6A4 P31645 1/20 0.35
SHBG P04278 1/20 0.34
ADRB2 P07550 2/20 0.33
RCOR1 Q9UKL0 1/20 0.33
PTGS1 P23219 3/20 0.32
PTGS2 P35354 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
FABP2 P12104 1/20 0.32
TSHR P16473 1/20 0.32
AKR1C4 P17516 1/20 0.32
ADRA2B P18089 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2C P28335 1/20 0.32
DRD3 P35462 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32

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
SCHEMBL30910946 1.00 KDM1A (0.36) KDM1AKCNH2KDM1BSLC6A4SHBG
SCHEMBL2609188 0.84 LMNA (0.40) KDM1AKCNH2KDM1BSLC6A4ADRB2
SCHEMBL4444491 0.83 PARP1 (0.41) SHBGADRB2ADRA2BCYP1A2CYP2C9
SCHEMBL14831424 0.82 KDM1A (0.38) KDM1AKCNH2KDM1BSLC6A4ADRB2
SCHEMBL30846954 0.82 CES2 (0.41) SHBGPTGS1PTGS2MEN1KMT2A
SCHEMBL3518451 0.82 CES2 (0.41) SHBGPTGS1PTGS2MEN1KMT2A
SCHEMBL3681339 0.82 KDM1A (0.38) KDM1AKCNH2KDM1BSLC6A4SHBG
SCHEMBL29453127 0.82 KDM1A (0.38) KDM1AKCNH2KDM1BSLC6A4ADRB2
SCHEMBL16043564 0.81 ADRB2 (0.40) KDM1AKCNH2KDM1BSLC6A4ADRB2
SCHEMBL14966853 0.81 UGT2B7 (0.44) KDM1AKCNH2KDM1BSLC6A4SHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112654621-B Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2024-05-14 CN disclosed
EP-3814348-B9 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-11-01 EP disclosed
EP-3814348-B1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2023-08-02 EP disclosed
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 US disclosed
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 US disclosed
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 US disclosed
US-20220324859-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2022-10-13 US disclosed
EP-3814348-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS Bristol-Myers Squibb Company (US) 2021-05-05 EP disclosed
CN-112654621-A Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2021-04-13 CN disclosed
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-23 US disclosed
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-23 US disclosed
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-02 US disclosed
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-02 US disclosed
US-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2020-04-09 US disclosed
US-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS SYNGENE INTERNATIONAL LIMITED (IN) 2020-04-09 US disclosed
CN-102753558-A Nitroimidazooxazines and their use in antitubercular therapy GLOBAL ALLIANCE FOR TB DRUG DEV 2012-10-24 CN disclosed
CN-102066337-A 5-hydroxypyrimidine-4-carboxamide compounds DAIICHI SANKYO CO LTD 2011-05-18 CN disclosed
CN-100548986-C Cathepsin cysteine protease inhibitors MERCK FROSST CANADA INC (CA) 2009-10-14 CN disclosed
CN-101379054-A Piperidine derivatives as CXCR3 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2009-03-04 CN disclosed
CN-1906164-A Cathepsin cysteine protease inhibitors MERCK FROSST CANADA INC (CA) 2007-01-31 CN 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 (5 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-20220324859-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG KDM1A 1835/4885KCNH2 2003/4885KDM1B 1890/4885
US-20200109140-A1 SUBSTITUTED NAPHTHYRIDINONE COMPOUNDS USEFUL AS T CELL ACTIVATORS DGKZ, DGKA, DGKG KDM1A 1835/4885KCNH2 2003/4885KDM1B 1890/4885
US-11713316-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG KDM1A 1835/4885KCNH2 2003/4885KDM1B 1890/4885
US-10669272-B2 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG KDM1A 1835/4885KCNH2 2003/4885KDM1B 1890/4885
US-10954238-B1 Substituted naphthyridinone compounds useful as T cell activators DGKZ, DGKA, DGKG KDM1A 1835/4885KCNH2 2003/4885KDM1B 1890/4885

“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.