SCHEMBL626770

SCHEMBL626770

CCCCCCC(CCC)C(CCCC)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.52
FFAR1 O14842 2/20 0.52
MAPT P10636 1/20 0.50
LCK P06239 1/20 0.50
PPARD Q03181 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
CA2 P00918 2/20 0.48
ACE2 Q9BYF1 1/20 0.47
MAPK1 P28482 1/20 0.44
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
ZDHHC7 Q9NXF8 1/20 0.42

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
SCHEMBL4587471 0.98 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2373767 0.98 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL626862 0.98 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7134892 0.96 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL19066785 0.96 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28046653 0.96 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2492300 0.96 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL17685264 0.94 GPR84 (0.57) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9770059 0.94 GPR84 (0.57) GPR84FFAR1MAPTLCKPPARD
SCHEMBL268638 0.94 GPR84 (0.57) GPR84FFAR1MAPTLCKPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230277571-A1 THERAPEUTIC USES OF PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLIC BORONIC ACID ESTER DERIVATIVES MELINTA SUBSIDIARY CORP. 2023-09-07 US disclosed
EP-3666778-B1 CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF MELINTA THERAPEUTICS INC (US) 2021-11-10 EP disclosed
US-11090319-B2 Therapeutic uses of pharmaceutical compositions comprising cyclic boronic acid ester derivatives MELINTA SUBSIDIARY CORP. (US) 2021-08-17 US disclosed
US-20200222434-A1 THERAPEUTIC USES OF PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLIC BORONIC ACID ESTER DERIVATIVES MELINTA SUBSIDIARY CORP. 2020-07-16 US disclosed
EP-3666778-A1 A CRYSTALLINE CYCLIC BORONIC ACID ESTER DERIVATIVE, METHOD FOR THE PREPARATION AND THERAPEUTIC USES THEREOF Rempex Pharmaceuticals, Inc. (US) 2020-06-17 EP disclosed
US-10639318-B2 Therapeutic uses of pharmaceutical compositions comprising cyclic boronic acid ester derivatives REMPEX PHARMACEUTICALS, INC. (US) 2020-05-05 US disclosed
EP-3412676-B1 CYCLIC BORONIC ACID ESTER DERIVATIVES, METHOD FOR THE PREPARATION AND THERAPEUTIC USES THEREOF REMPEX PHARMACEUTICALS INC (US) 2020-02-12 EP disclosed
US-20190076449-A1 THERAPEUTIC USES OF PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLIC BORONIC ACID ESTER DERIVATIVES MELINTA SUBSIDIARY CORP. 2019-03-14 US disclosed
US-10183034-B2 Therapeutic uses of pharmaceutical compositions comprising cyclic boronic acid ester derivatives REMPEX PHARMACEUTICALS, INC. (US) 2019-01-22 US disclosed
EP-3412676-A1 METHOD FOR THE PREPARATION OF CYCLIC BORONIC ACID ESTER DERIVATIVES Rempex Pharmaceuticals, Inc. (US) 2018-12-12 EP disclosed
US-20160220591-A1 CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF MELINTA SUBSIDIARY CORP. 2016-08-04 US disclosed
EP-2814483-A2 METHODS OF TREATING BACTERIAL INFECTIONS Rempex Pharmaceuticals, Inc. (US) 2014-12-24 EP disclosed
WO-2013122888-A2 METHODS OF TREATING BACTERIAL INFECTIONS REMPEX PHARMACEUTICALS, INC. (US) 2013-08-22 WO disclosed
EP-2603514-A1 CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF Rempex Pharmaceuticals, Inc. (US) 2013-06-19 EP disclosed
WO-2012021455-A1 CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF REMPEX PHARMACEUTICALS, INC. (US) 2012-02-16 WO disclosed
WO-2008046554-A1 PROPYLALKYL ESTERS AS OIL PHASE IN BOREHOLE TREATMENT COMPOSITIONS COGNIS OLEOCHEMICALS GMBH (DE) 2008-04-24 WO disclosed
EP-1914288-A1 Propylalkyl esters as oleaginous phase in well treatment fluids Cognis Oleochemicals GmbH (DE) 2008-04-23 EP disclosed
EP-0550779-B1 Cosmetic and dermatologic composition containing diol diesters NESTLE SA (CH) 1995-10-18 EP disclosed
EP-0441992-B1 Process for preparing salolein and cosmetic compositious therewith NESTLE SA (CH) 1995-01-18 EP disclosed
EP-0550779-A1 Cosmetic and dermatologic composition containing diol diesters SOCIETE DES PRODUITS NESTLE S.A. (CH) 1993-07-14 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 (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-10183034-B2 Therapeutic uses of pharmaceutical compositions comprising cyclic boronic acid ester derivatives BCL6B, BCL6, SLC10A2 GPR84 3014/4885FFAR1 1899/4885MAPT 4088/4885
US-20160220591-A1 CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF BCL6B, BCL6, BCL9 GPR84 2042/4885FFAR1 1281/4885MAPT 4223/4885
US-20200222434-A1 THERAPEUTIC USES OF PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLIC BORONIC ACID ESTER DERIVATIVES BCL6B, BCL6, SLC10A2 GPR84 3014/4885FFAR1 1899/4885MAPT 4088/4885
US-10639318-B2 Therapeutic uses of pharmaceutical compositions comprising cyclic boronic acid ester derivatives BCL6B, BCL6, SLC10A2 GPR84 3014/4885FFAR1 1899/4885MAPT 4088/4885
US-20190076449-A1 THERAPEUTIC USES OF PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLIC BORONIC ACID ESTER DERIVATIVES BCL6B, BCL6, SLC10A2 GPR84 3014/4885FFAR1 1899/4885MAPT 4088/4885
US-11090319-B2 Therapeutic uses of pharmaceutical compositions comprising cyclic boronic acid ester derivatives BCL6B, BCL6, SLC10A2 GPR84 3014/4885FFAR1 1899/4885MAPT 4088/4885
US-20230277571-A1 THERAPEUTIC USES OF PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLIC BORONIC ACID ESTER DERIVATIVES BCL6B, BCL6, SLC10A2 GPR84 3014/4885FFAR1 1899/4885MAPT 4088/4885

“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.