SCHEMBL1690791

SCHEMBL1690791

O=CC(CC(=O)O)NC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 10/20 0.55
CASP3 P42574 3/20 0.54
CTRB1 P17538 2/20 0.52
CTSB P07858 1/20 0.51
CTSK P43235 1/20 0.51
PSMB1 P20618 1/20 0.51
PSMB5 P28074 1/20 0.51
PSMB2 P49721 1/20 0.51

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
SCHEMBL4425695 1.00 CASP1 (0.55) CASP1CASP3CTRB1CTSBCTSK
SCHEMBL7349773 0.89 CTRB1 (0.50) CASP1CTRB1CTSBCTSKPSMB1
SCHEMBL8458845 0.89 CTRB1 (0.50) CASP1CTRB1CTSBCTSKPSMB1
SCHEMBL10277666 0.87 CTSK (0.51) CASP1CTRB1CTSBCTSKPSMB1
SCHEMBL10277668 0.87 CTSK (0.51) CASP1CTRB1CTSBCTSKPSMB1
SCHEMBL25992762 0.87 CTSK (0.51) CASP1CTRB1CTSBCTSKPSMB1
SCHEMBL13173061 0.87 CTRB1 (0.54) CTRB1CTSBCTSKPSMB1PSMB5
SCHEMBL5275940 0.87 CTSK (0.59) CTRB1CTSBCTSKPSMB1PSMB5
SCHEMBL630290 0.87 CTSB (0.66) CTRB1CTSB
SCHEMBL7298029 0.87 CTRB1 (0.54) CTRB1CTSBCTSKPSMB1PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3692028-B1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 FORMA THERAPEUTICS INC (US) 2023-04-26 EP disclosed
US-20220185806-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 FORMA THERAPEUTICS, INC. 2022-06-16 US disclosed
US-11247987-B2 Inhibiting ubiquitin specific peptidase 30 FORMA THERAPEUTICS, INC. (US) 2022-02-15 US disclosed
US-20200317658-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 FORMA THERAPEUTICS, INC. 2020-10-08 US disclosed
EP-3692028-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 Forma Therapeutics, Inc. (US) 2020-08-12 EP disclosed
WO-2019071073-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 FORMA THERAPEUTICS, INC. (US) 2019-04-11 WO disclosed
CN-106831734-A A kind of total synthesis method of and agromycin A 中国医学科学院医药生物技术研究所 2017-06-13 CN disclosed
US-20120010161-A1 NOVEL AZAPEPTIDE OR AZAPEPTIDOMIMETIC COMPOUNDS INHIBITING BCRP AND/OR P-GP CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-01-12 US disclosed
EP-1082127-A4 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER LAMBERT CO (US) 2002-10-09 EP disclosed
EP-1082127-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 2001-03-14 EP disclosed
EP-1073658-A1 PYRAZOLOPYRIMIDINONE CGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER INC. (US) 2001-02-07 EP disclosed
WO-1999056765-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-11-11 WO disclosed
WO-1999054333-A1 PYRAZOLOPYRIMIDINONE CGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER INC. (US) 1999-10-28 WO 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-20220185806-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 USP30, UCHL1, UCHL3 CASP1 1503/4885CASP3 942/4885CTRB1 2183/4885
US-11247987-B2 Inhibiting ubiquitin specific peptidase 30 USP30, UCHL1, UCHL3 CASP1 1002/4885CASP3 503/4885CTRB1 1770/4885
US-20200317658-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 USP30, UCHL1, UCHL3 CASP1 1503/4885CASP3 942/4885CTRB1 2183/4885
US-20120010161-A1 NOVEL AZAPEPTIDE OR AZAPEPTIDOMIMETIC COMPOUNDS INHIBITING BCRP AND/OR P-GP ABCB1, ABCB11, ABCC1 CASP1 1526/4885CASP3 998/4885CTRB1 3627/4885

“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.