SCHEMBL4669864

SCHEMBL4669864

CC(=O)N1CCC(N2CCCCC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 14/20 0.58
L3MBTL1 Q9Y468 12/20 0.58
MBTD1 Q05BQ5 5/20 0.58
TP53BP1 Q12888 2/20 0.55
L3MBTL4 Q8NA19 1/20 0.55
EPHX2 P34913 2/20 0.50
EPHX1 P07099 1/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL3938492 0.98 L3MBTL3 (0.56) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL13207179 0.94 L3MBTL3 (0.56) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL12801726 0.86 L3MBTL3 (0.56) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL10075487 0.83 POLB (0.58) L3MBTL3L3MBTL1EPHX2EPHX1KDM4E
SCHEMBL13453747 0.83 POLB (0.58) L3MBTL3L3MBTL1EPHX2EPHX1KDM4E
SCHEMBL13088457 0.83 POLB (0.58) L3MBTL3L3MBTL1EPHX2EPHX1KDM4E
SCHEMBL19630972 0.83 L3MBTL3 (0.58) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL6806463 0.83 L3MBTL3 (0.61) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL920191 0.83 L3MBTL3 (0.61) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL25628643 0.82 USP2 (0.43) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4

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 128 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023102472-A1 ANTIVIRAL PRODRUGS AND FORMULATIONS THEREOF THE SCRIPPS RESEARCH INSTITUTE (US) 2023-06-08 WO disclosed
US-20230159480-A1 SYNTHESIS OF ESUBERAPROST PRODRUGS UNITED THERAPEUTICS CORPORATION (US) 2023-05-25 US disclosed
US-20230159480-A1 SYNTHESIS OF ESUBERAPROST PRODRUGS UNITED THERAPEUTICS CORPORATION (US) 2023-05-25 US disclosed
US-11560363-B2 Synthesis of esuberaprost prodrugs UNITED THERAPEUTICS CORPORATION (US) 2023-01-24 US disclosed
EP-3458454-B1 2-HYDROXY-N-(BENZO[D]THIAZOL-2-YL)BENZAMIDE DERIVATIVES AS MITOCHONDRIAL UNCOUPLERS FOR THE TREATMENT OF METABOLIC DISEASES AND CANCER UNIV RUTGERS (US) 2021-11-24 EP disclosed
US-20210355095-A1 SYNTHESIS OF ESUBERAPROST PRODRUGS UNITED THERAPEUTICS CORPORATION (US) 2021-11-18 US disclosed
WO-2021226276-A2 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-11-11 WO disclosed
EP-3371192-B1 PODOPHYLLOTOXIN DERIVATIVES AND THEIR USE CALIFORNIA PACIFIC MEDICAL CENTER (US) 2020-06-03 EP disclosed
US-20190224220-A1 Carbidopa and L-Dopa Prodrugs and Methods of Use ABBVIE INC. (US) 2019-07-25 US disclosed
EP-2097097-B1 ANTIBODIES, IN PARTICULAR HUMAN ANTIBODIES, THAT BIND CD22 AND USES THEREOF SQUIBB & SONS LLC (US) 2018-05-30 EP disclosed
US-20070265263-A1 Heterocyclic inhibitors of ERK2 and uses thereof CAO JINGRONG 2007-11-15 US disclosed
US-20070254915-A1 CXCR4 MODULATORS CHEMOCENTRYX, INC. (US) 2007-11-01 US disclosed
US-20070135346-A1 Prodrugs of CC-1065 analogs IMMUNOGEN INC. 2007-06-14 US disclosed
US-20070093432-A1 Camptothecin derivatives as chemoradiosensitizing agents CALIFORNIA PACIFIC MEDICAL CENTER 2007-04-26 US disclosed
US-7202239-B2 Cyclohexylphenyl carboxamides tocolytic oxytocin receptor antagonists WYETH (US) 2007-04-10 US disclosed
US-20070072865-A1 Bicyclic piperazine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-29 US disclosed
US-20070072865-A1 Bicyclic piperazine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-29 US disclosed
WO-2007016496-A2 DIPIPERAZINYL KETONES AND RELATED ANALOGUES NEUROGEN CORPORATION (US) 2007-02-08 WO disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US 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-20070265263-A1 Heterocyclic inhibitors of ERK2 and uses thereof MAPK1, MAPK3, MAPKAPK2 L3MBTL3 2148/4885L3MBTL1 1804/4885MBTD1 1780/4885
US-11560363-B2 Synthesis of esuberaprost prodrugs DCPS, DNPEP, NPEPPS L3MBTL3 2608/4885L3MBTL1 2044/4885MBTD1 3154/4885
US-20230159480-A1 SYNTHESIS OF ESUBERAPROST PRODRUGS DCPS, DNPEP, NPEPPS L3MBTL3 2608/4885L3MBTL1 2044/4885MBTD1 3154/4885
US-20070093432-A1 Camptothecin derivatives as chemoradiosensitizing agents ERCC2, CHEK1, ERCC4 L3MBTL3 1559/4885L3MBTL1 1052/4885MBTD1 902/4885
US-20210355095-A1 SYNTHESIS OF ESUBERAPROST PRODRUGS DCPS, DNPEP, NPEPPS L3MBTL3 2608/4885L3MBTL1 2044/4885MBTD1 3154/4885
US-20070072865-A1 Bicyclic piperazine compound and use thereof GPR3, FFAR3, LPAR3 L3MBTL3 1122/4885L3MBTL1 2503/4885MBTD1 3134/4885
US-20190224220-A1 Carbidopa and L-Dopa Prodrugs and Methods of Use COMT, SNCA, PARK7 L3MBTL3 768/4885L3MBTL1 563/4885MBTD1 3275/4885
US-20070254915-A1 CXCR4 MODULATORS CXCL12, CXCR4, CXCR1 L3MBTL3 3355/4885L3MBTL1 2170/4885MBTD1 943/4885
US-20070135346-A1 Prodrugs of CC-1065 analogs CASP5, DNPEP, PRCP L3MBTL3 2653/4885L3MBTL1 2095/4885MBTD1 3336/4885

“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.