SCHEMBL4404302

SCHEMBL4404302

C=CCCCC(CO)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
ABCC4 O15439 1/20 0.42
TBXAS1 P24557 3/20 0.38
SLC1A1 P43005 1/20 0.38
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38
GRIK1 P39086 2/20 0.37
GRIK2 Q13002 2/20 0.37
CPA1 P15085 1/20 0.36
CPB2 Q96IY4 1/20 0.35
FOLH1 Q04609 1/20 0.34
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DDAH1 O94760 1/20 0.33
CHRM1 P11229 1/20 0.33
AKR1A1 P14550 1/20 0.33

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
SCHEMBL4404306 1.00 MAPT (0.42) MAPTABCC4TBXAS1SLC1A1CA2
SCHEMBL20139943 0.94 MAPT (0.45) MAPTABCC4TBXAS1SLC1A1CA2
SCHEMBL3944731 0.94 MAPT (0.45) MAPTABCC4TBXAS1SLC1A1CA2
SCHEMBL3779386 0.89 ABCC4 (0.46) MAPTABCC4TBXAS1CA2MAPK1
SCHEMBL7003560 0.86 ABCC4 (0.41) MAPTABCC4TBXAS1CA2MAPK1
SCHEMBL5975672 0.85 MAPT (0.48) MAPTABCC4CA2MAPK1GRIK1
SCHEMBL5494036 0.85 ABCC4 (0.43) MAPTABCC4TBXAS1CA2MAPK1
SCHEMBL2135519 0.83 GRIK1 (0.50) MAPTABCC4TBXAS1CA2MAPK1
SCHEMBL4016679 0.83 MAPT (0.50) MAPTABCC4CA2MAPK1GRIK1
SCHEMBL7975761 0.82 FOLH1 (0.52) MAPTABCC4TBXAS1CA2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3538526-B1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2024-04-10 EP disclosed
US-11639353-B2 Cyclobutanes- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2023-05-02 US disclosed
US-11639353-B2 Cyclobutanes- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2023-05-02 US disclosed
CN-110167934-B Cyclobutane-and azetidine-containing monocyclic and spiro compounds as alpha V integrin inhibitors 百时美施贵宝公司 2022-06-10 CN disclosed
US-20210246136-A1 CYCLOBUTANES- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-08-12 US disclosed
US-11014922-B2 Cyclobutane- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-05-25 US disclosed
EP-3538526-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS Bristol-Myers Squibb Company (US) 2019-09-18 EP disclosed
US-20190270741-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-05 US disclosed
WO-2018089355-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 WO disclosed
US-20090203631-A1 PEPTIDE DEFORMYLASE INHIBITORS AS NOVEL ANTIBIOTICS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-08-13 US disclosed
US-7538085-B2 Macrocyclic peptide antibiotics; drug resistant, drug sensitive bacterial infections THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-05-26 US disclosed
US-20070259812-A1 Peptide deformylase inhibitors as novel antibiotics THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION 2007-11-08 US disclosed
US-7208595-B2 Peptide deformylase inhibitors as novel antibiotics THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2007-04-24 US disclosed
US-20050026821-A1 Peptide deformylase inhibitors as novel antibiotics NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2005-02-03 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 (7 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-20190270741-A1 CYCLOBUTANE- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS ITGB1, ITGAV, ITGA1 MAPT 1177/4885ABCC4 1951/4885TBXAS1 514/4885
US-20090203631-A1 PEPTIDE DEFORMYLASE INHIBITORS AS NOVEL ANTIBIOTICS PDF, PADI3, PADI6 MAPT 4179/4885ABCC4 2985/4885TBXAS1 2194/4885
US-20210246136-A1 CYCLOBUTANES- AND AZETIDINE-CONTAINING MONO AND SPIROCYCLIC COMPOUNDS AS ALPHA V INTEGRIN INHIBITORS ITGB1, ITGAV, ITGA1 MAPT 1315/4885ABCC4 1754/4885TBXAS1 402/4885
US-11639353-B2 Cyclobutanes- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors ITGB1, ITGB2, ITGA1 MAPT 864/4885ABCC4 2044/4885TBXAS1 425/4885
US-11014922-B2 Cyclobutane- and azetidine-containing mono and spirocyclic compounds as αV integrin inhibitors ITGB1, ITGB2, ITGA1 MAPT 738/4885ABCC4 2039/4885TBXAS1 598/4885
US-20070259812-A1 Peptide deformylase inhibitors as novel antibiotics PDF, PADI3, PADI6 MAPT 4179/4885ABCC4 2985/4885TBXAS1 2194/4885
US-20050026821-A1 Peptide deformylase inhibitors as novel antibiotics PDF, PADI3, PADI6 MAPT 4179/4885ABCC4 2985/4885TBXAS1 2194/4885

“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.