SCHEMBL2643540

SCHEMBL2643540

CCCCCCCC(CC(=O)O)C(=O)OCC

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.55
CPB2 Q96IY4 2/20 0.50
MMP2 P08253 6/20 0.49
MMP3 P08254 5/20 0.49
MMP1 P03956 3/20 0.49
MMP7 P09237 1/20 0.49
CA2 P00918 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
GRIK1 P39086 1/20 0.45
GRIK2 Q13002 1/20 0.45
FFAR1 O14842 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44

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
SCHEMBL481493 1.00 GPR84 (0.55) GPR84CPB2MMP2MMP3MMP1
SCHEMBL27622663 1.00 GPR84 (0.55) GPR84CPB2MMP2MMP3MMP1
SCHEMBL29014239 0.98 GPR84 (0.52) GPR84CPB2MMP2MMP3MMP1
SCHEMBL5180252 0.88 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL11655019 0.88 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL14672526 0.88 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL6560418 0.88 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL14672449 0.88 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL8749767 0.88 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
Hexane SCHEMBL11311103 0.88 GPR84 (0.44) GPR84CPB2MMP2MMP3MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11884624-B2 Difluorolactam compounds as EP4 receptor-selective agonists for use in the treatment of EP4-mediated diseases and conditions CAYMAN CHEMICAL COMPANY, INC. (US) 2024-01-30 US disclosed
EP-3130583-B1 KYNURENINE-3-MONOOXYGENASE INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF CHDI FOUNDATION INC (US) 2024-01-03 EP disclosed
US-20230050318-A1 DIFLUOROLACTAM COMPOUNDS AS EP4 RECEPTOR-SELECTIVE AGONISTS FOR USE IN THE TREATMENT OF EP4-MEDIATED DISEASES AND CONDITIONS CAYMAN CHEMICAL COMPANY, INC. 2023-02-16 US disclosed
US-11345690-B2 Methods of synthesizing a difluorolactam analog CAYMAN CHEMICAL COMPANY, INC. (US) 2022-05-31 US disclosed
US-20220127252-A9 METHODS OF SYNTHESIZING A DIFLUOROLACTAM ANALOG CAYMAN CHEMICAL CO INC (US) 2022-04-28 US disclosed
US-11066361-B2 Difluorolactam compounds as EP4 receptor-selective agonists for use in the treatment of EP4-mediated diseases and conditions CAYMAN CHEMICAL COMPANY, INC. (US) 2021-07-20 US disclosed
CN-107802623-B Difluorolactam compositions for EP 4-mediated bone-related diseases and disorders 开曼化学股份有限公司 2020-10-30 CN disclosed
US-10729810-B2 Methods, systems, and compositions for promoting bone growth CAYMAN CHEMICAL COMPANY, INC (US) 2020-08-04 US disclosed
CN-106748951-B Difluorolactam compounds as EP4 receptor selective agonists for use in the treatment of EP4 mediated diseases and conditions 开曼化学股份有限公司 2020-07-24 CN disclosed
US-20200207709-A1 DIFLUOROLACTAM COMPOUNDS AS EP4 RECEPTOR-SELECTIVE AGONISTS FOR USE IN THE TREATMENT OF EP4-MEDIATED DISEASES AND CONDITIONS CAYMAN CHEMICAL COMPANY, INC. 2020-07-02 US disclosed
EP-0065638-B1 SUBSTITUTED 7-(4-SUBSTITUTED-CYCLOPENT-2-EN-1-ON-2-YL)-HEPT-2-TRANSENOATES AMERICAN CYANAMID COMPANY (US) 1989-01-25 EP disclosed
US-4644079-A Precursors and synthesis of d1-(methyl)-16,16-(dimethyl)-11-alpha, 15-alpha, beta-dihydroxy-9-oxo-2,13,-trans, trans-prostadienoates AMERICAN CYANAMID COMPANY (US) 1987-02-17 US disclosed
US-4549030-A PROSTAGLANDIN DERIVATIVES THE UPJOHN COMPANY (US) 1985-10-22 US disclosed
US-4535173-A Intermediates for the production of prostaglandins from D-glucose THE UPJOHN COMPANY (US) 1985-08-13 US disclosed
US-4474979-A Synthesis of d1-(methyl)-16,16-(dimethyl-11-alpha, 15-alpha, beta-dihydroxy-9-oxo-2,13,-trans,trans-prostadienoates AMERICAN CYANAMID COMPANY (US) 1984-10-02 US disclosed
EP-0113561-A2 Prostaglandin intermediates, their synthesis and their conversion to prostaglandins THE UPJOHN COMPANY (US) 1984-07-18 EP disclosed
EP-0065638-A1 Substituted 7-(4-substituted-cyclopent-2-en-1-on-2-yl)-hept-2-transenoates AMERICAN CYANAMID COMPANY (US) 1982-12-01 EP disclosed
US-4360688-A Precursors and synthesis of d1-(methyl)-16,16-(dimethyl)-11-alpha, 15-alpha, beta-dihydroxy-9-oxo-2,13,-trans, trans-prostadienoates AMERICAN CYANAMID COMPANY (US) 1982-11-23 US disclosed
US-4254036-A 1-Hydroxymethyl-1-oxo-prostane-derivatives of the E, A and F-series AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
EP-0015056-A1 1-Hydroxymethyl-1-oxo-prostane derivatives of the E, A and F series AMERICAN CYANAMID COMPANY (US) 1980-09-03 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 (6 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-20230050318-A1 DIFLUOROLACTAM COMPOUNDS AS EP4 RECEPTOR-SELECTIVE AGONISTS FOR USE IN THE TREATMENT OF EP4-MEDIATED DISEASES AND CONDITIONS PTGER4, PTGER1, PTGER3 GPR84 20/4885CPB2 4526/4885MMP2 3638/4885
US-11066361-B2 Difluorolactam compounds as EP4 receptor-selective agonists for use in the treatment of EP4-mediated diseases and conditions PTGER4, PTGER1, PTGER3 GPR84 20/4885CPB2 4526/4885MMP2 3638/4885
US-11884624-B2 Difluorolactam compounds as EP4 receptor-selective agonists for use in the treatment of EP4-mediated diseases and conditions PTGER4, PTGER1, PTGER3 GPR84 20/4885CPB2 4526/4885MMP2 3638/4885
US-11345690-B2 Methods of synthesizing a difluorolactam analog PTGER4, PTGER1, PTGIR GPR84 21/4885CPB2 4836/4885MMP2 3575/4885
US-20220127252-A9 METHODS OF SYNTHESIZING A DIFLUOROLACTAM ANALOG PTGER4, PTGER1, PTGIR GPR84 21/4885CPB2 4836/4885MMP2 3575/4885
US-20200207709-A1 DIFLUOROLACTAM COMPOUNDS AS EP4 RECEPTOR-SELECTIVE AGONISTS FOR USE IN THE TREATMENT OF EP4-MEDIATED DISEASES AND CONDITIONS PTGER4, PTGER1, PTGER3 GPR84 20/4885CPB2 4526/4885MMP2 3638/4885

“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.