SCHEMBL555191

SCHEMBL555191

COC(=O)CC(CO)NC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 2/20 0.57
SYK P43405 1/20 0.51
ATM Q13315 2/20 0.50
CASP1 P29466 3/20 0.49
ALDH1A1 P00352 2/20 0.49
TRPM8 Q7Z2W7 1/20 0.49
ALOX15 P16050 1/20 0.49
KYNU Q16719 1/20 0.48
ABCB1 P08183 1/20 0.48
CTSK P43235 3/20 0.48
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP1A2 P05177 1/20 0.47
POLB P06746 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
CTSL P07711 2/20 0.47
CTSS P25774 2/20 0.47
ELANE P08246 1/20 0.47

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
SCHEMBL79250 1.00 CTRB1 (0.57) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL555192 1.00 CTRB1 (0.57) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL10966776 0.93 CTRB1 (0.61) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL7986494 0.89 CTRB1 (0.54) CTRB1SYKATMCASP1CTSK
SCHEMBL10964840 0.89 CTRB1 (0.57) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL14530318 0.89 SYK (0.60) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL14531561 0.89 SYK (0.60) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL10964829 0.89 CTRB1 (0.57) CTRB1SYKATMCASP1ALDH1A1
SCHEMBL28184491 0.89 CTRB1 (0.68) CTRB1SYKATMALDH1A1TRPM8
SCHEMBL7280375 0.89 CTRB1 (0.68) CTRB1SYKATMALDH1A1TRPM8

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
CN-111148743-B Inhibition of ubiquitin-specific peptidase 30 福马治疗有限公司 2023-12-15 CN disclosed
EP-2601177-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (SE) 2017-10-18 EP disclosed
US-20160176906-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-06-23 US disclosed
US-9248140-B2 Chemical compounds ASTRAZENECA AB (SE) 2016-02-02 US disclosed
US-20150328239-A1 Chemical Compounds ASTRAZENECA AB (SE) 2015-11-19 US disclosed
US-9018381-B2 Chemical compounds ASTRAZENECA AB (SE) 2015-04-28 US disclosed
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (UK) 2013-11-21 US disclosed
EP-2601177-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS AstraZeneca AB (SE) 2013-06-12 EP disclosed
US-20120035134-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2012-02-09 US disclosed
WO-2012017251-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (SE) 2012-02-09 WO disclosed
CN-102304064-A Method for preparing intermediate of Sitagliptin HENGDIAN GROUP JIAYUAN CHEMICAL INDUSTRY CO LTD 2012-01-04 CN disclosed
US-20070219192-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-09-20 US disclosed
US-20070219192-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-09-20 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 (5 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-20070219192-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 CTRB1 4217/4885SYK 4470/4885ATM 1110/4885
US-20120035134-A1 CHEMICAL COMPOUNDS BCL2, BCL2L1, BAX CTRB1 2752/4885SYK 2797/4885ATM 2721/4885
US-20150328239-A1 Chemical Compounds BCL2, BCL2L1, BAX CTRB1 2752/4885SYK 2797/4885ATM 2721/4885
US-20160176906-A1 Chemical Compounds BCL2, BCL2L1, BAX CTRB1 2752/4885SYK 2797/4885ATM 2721/4885
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BCL2, BAX, BCLAF1 CTRB1 1929/4885SYK 4274/4885ATM 1506/4885

“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.