SCHEMBL21386592

SCHEMBL21386592

CN1CCN(CCOI)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 2/20 0.40
LTA4H P09960 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
PAOX Q6QHF9 1/20 0.36
HRH3 Q9Y5N1 3/20 0.36
NPC1 O15118 2/20 0.36
DRD3 P35462 1/20 0.36
RAB9A P51151 1/20 0.36
MC4R P32245 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL21664479 0.93 ALDH1A1 (0.37) ALDH1A1KDM4ELTA4HMEN1KMT2A
SCHEMBL15495130 0.87 ALDH1A1 (0.50) ALDH1A1KDM4ELTA4HMEN1KMT2A
SCHEMBL14041545 0.86 HRH3 (0.45) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL21907048 0.83 ALDH1A1 (0.44) ALDH1A1KDM4ELTA4HMEN1KMT2A
SCHEMBL16622424 0.83 HSD11B1 (0.41) ALDH1A1KDM4EMEN1KMT2ANPC1
SCHEMBL20331332 0.82 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1KMT2AUSP2
SCHEMBL26445641 0.79 DAO (0.40) HRH3NPC1DRD3
SCHEMBL25864036 0.79
SCHEMBL2512123 0.79 ALDH1A1 (0.55) ALDH1A1KDM4ELTA4HMEN1KMT2A
SCHEMBL22964563 0.78 KDM4E (0.32) KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024054766-A2 MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER MITO BIOPHARMA, LLC (US) 2024-03-14 WO disclosed
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2024-01-02 US disclosed
EP-3848363-B1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND MEDSHINE DISCOVERY INC (CN) 2023-07-19 EP disclosed
US-20230151136-A1 CATALYST COMPOSITION FOR POLYURETHANES MOMENTIVE PERFORMANCE MATERIALS INC. 2023-05-18 US disclosed
US-20210292313-A1 SUBSTITUTED PHENAZINES AND METHODS OF TREATING CANCER AND BACTERIAL DISEASES Rongved, Pål (NO) 2021-09-23 US disclosed
EP-3848363-A1 TRICYCLIC SUBSTITUTED PIPERIDINE DIONE COMPOUND Medshine Discovery Inc. (CN) 2021-07-14 EP disclosed
EP-3543227-B1 FGFR4 INHIBITOR AND PREPARATION METHOD AND USE THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2020-12-30 EP disclosed
US-10723717-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides ARVINAS OPERATIONS, INC. (US) 2020-07-28 US disclosed
US-20200155689-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. 2020-05-21 US disclosed
EP-3543227-A1 FGFR4 INHIBITOR AND PREPARATION METHOD AND USE THEREOF Guangdong Zhongsheng Pharmaceutical Co., Ltd (CN) 2019-09-25 EP 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 (4 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-20210292313-A1 SUBSTITUTED PHENAZINES AND METHODS OF TREATING CANCER AND BACTERIAL DISEASES TLR5, TOP2A, SCN5A ALDH1A1 2277/4885KDM4E 1515/4885LTA4H 3545/4885
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use LRRK2, ADRM1, CRBN ALDH1A1 4021/4885KDM4E 1434/4885LTA4H 3770/4885
US-20200155689-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME CRBN, CBL, MDM2 ALDH1A1 3671/4885KDM4E 1613/4885LTA4H 3535/4885
US-10723717-B2 Compounds and methods for the targeted degradation of rapidly accelerated fibrosarcoma polypeptides CRBN, ARAF, VHL ALDH1A1 2833/4885KDM4E 3116/4885LTA4H 3562/4885

“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.