SCHEMBL12220545

SCHEMBL12220545

CCC(CC)NC(=O)OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.69
CTRB1 P17538 2/20 0.66
ATM Q13315 1/20 0.57
CTSK P43235 4/20 0.56
CTSL P07711 4/20 0.56
CTSS P25774 4/20 0.56
CTSB P07858 2/20 0.56
MEN1 O00255 1/20 0.54
LMNA P02545 1/20 0.54
KMT2A Q03164 1/20 0.54
ELANE P08246 1/20 0.53
ALDH1A1 P00352 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
TRPM8 Q7Z2W7 1/20 0.52
ALOX15 P16050 1/20 0.52

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
SCHEMBL11528148 0.92 SYK (0.64) SYKCTRB1ATMCTSKCTSL
SCHEMBL8900969 0.92 CTRB1 (0.74) SYKCTRB1ATMCTSKCTSL
SCHEMBL213314 0.92 SYK (0.64) SYKCTRB1ATMCTSKCTSL
SCHEMBL2636259 0.92 SYK (0.64) SYKCTRB1ATMCTSKCTSL
SCHEMBL14595243 0.92 CTRB1 (0.74) SYKCTRB1ATMCTSKCTSL
SCHEMBL27351869 0.91 SYK (0.63) SYKCTRB1ATMCTSKCTSL
SCHEMBL15288192 0.91 SYK (0.63) SYKCTRB1ATMCTSKCTSL
SCHEMBL10250740 0.91 SYK (0.63) SYKCTRB1ATMCTSKCTSL
SCHEMBL20315241 0.91 CTRB1 (0.76) SYKCTRB1ATMCTSKCTSL
SCHEMBL1051345 0.90 SYK (0.62) SYKCTRB1ATMCTSKCTSL

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
US-11661621-B2 Self-immolative probes for enzyme activity detection ENZO LIFE SCIENCES, INC. (US) 2023-05-30 US disclosed
US-20230159563-A1 TRICYCLIC PYRIDONES AND PYRIMIDONES ERASCA, INC. 2023-05-25 US disclosed
US-11572398-B2 GLP-1 derivatives and uses thereof NOVO NORDISK A/S (DK) 2023-02-07 US disclosed
US-20200291448-A1 SELF-IMMOLATIVE PROBES FOR ENZYME ACTIVITY DETECTION ENZO LIFE SCIENCES, INC. (US) 2020-09-17 US disclosed
CN-110016020-A Compound or pharmaceutically acceptable salt thereof, application and pharmaceutical composition thereof 铁木医药有限公司 2019-07-16 CN disclosed
CN-109384778-A Use of a compound or a pharmaceutically acceptable salt thereof for the manufacture of a medicament for the treatment of a disease, health condition or disorder 铁木医药有限公司 2019-02-26 CN disclosed
CN-109369635-A Compound or pharmaceutically acceptable salt thereof, application and pharmaceutical composition thereof 铁木医药有限公司 2019-02-22 CN disclosed
CN-108912111-A compounds and pharmaceutical compositions 铁木医药有限公司 2018-11-30 CN disclosed
CN-105408328-B sGC stimulators 铁木医药有限公司 2018-11-16 CN disclosed
US-20170320927-A1 GLP-1 Derivatives and Uses Thereof NOVO NORDISK A/S (DK) 2017-11-09 US disclosed
US-9574222-B2 Self-immolative probes for enzyme activity detection ENZO LIFE SCIENCES, INC. (US) 2017-02-21 US disclosed
EP-1613420-B1 METHOD FOR SELECTIVELY BINDING A SUBSTRATE TO SORBENTS BY WAY OF AT LEAST BIVALENT BONDS INSTRACTION GMBH (DE) 2015-05-13 EP disclosed
US-20110257028-A1 Method for selectively binding a substrate to sorbents by way of at least bivalent bonds INSTRACTION GMBH (DE) 2011-10-20 US disclosed
US-20110257028-A1 Method for selectively binding a substrate to sorbents by way of at least bivalent bonds INSTRACTION GMBH (DE) 2011-10-20 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 (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-20110257028-A1 Method for selectively binding a substrate to sorbents by way of at least bivalent bonds SPR, ABCG2, SHBG SYK 2408/4885CTRB1 1252/4885ATM 4670/4885
US-11572398-B2 GLP-1 derivatives and uses thereof GLP1R, GIPR, GCG SYK 4428/4885CTRB1 1130/4885ATM 4864/4885
US-11661621-B2 Self-immolative probes for enzyme activity detection MGAM, SI, ENGASE SYK 712/4885CTRB1 2669/4885ATM 1887/4885
US-20200291448-A1 SELF-IMMOLATIVE PROBES FOR ENZYME ACTIVITY DETECTION MGAM, SI, ENGASE SYK 712/4885CTRB1 2669/4885ATM 1887/4885
US-20170320927-A1 GLP-1 Derivatives and Uses Thereof GLP1R, GIPR, GCG SYK 4428/4885CTRB1 1130/4885ATM 4864/4885
US-20230159563-A1 TRICYCLIC PYRIDONES AND PYRIMIDONES KRAS, NRAS, HRAS SYK 3852/4885CTRB1 1304/4885ATM 2038/4885

“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.