SCHEMBL6409052

SCHEMBL6409052

CC(C)(C)OC(=O)NC(CO)Cc1c[nH]c2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.63
CTSS P25774 1/20 0.63
CTSK P43235 1/20 0.63
HDAC3 O15379 5/20 0.62
HDAC4 P56524 5/20 0.62
HDAC1 Q13547 5/20 0.62
HDAC7 Q8WUI4 5/20 0.62
HDAC2 Q92769 5/20 0.62
HDAC10 Q969S8 5/20 0.62
HDAC11 Q96DB2 5/20 0.62
HDAC8 Q9BY41 5/20 0.62
HDAC6 Q9UBN7 5/20 0.62
HDAC9 Q9UKV0 5/20 0.62
HDAC5 Q9UQL6 5/20 0.62
TACR1 P25103 2/20 0.61
MAPT P10636 3/20 0.60
TP53 P04637 1/20 0.60
SSTR3 P32745 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ACE P12821 1/20 0.57

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
SCHEMBL29401065 1.00 CTSL (0.63) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL6833548 1.00 CTSL (0.63) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL3560147 1.00 CTSL (0.63) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL29398124 1.00 CTSL (0.63) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL4667151 0.91 CTSL (0.61) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL6409098 0.90 CTSL (0.62) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL21466531 0.90 CTSL (0.62) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL8592427 0.90 CTSL (0.62) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL23127370 0.89 ACE (0.66) CTSLCTSSCTSKHDAC3HDAC4
SCHEMBL21309842 0.89 CTSL (0.61) CTSLCTSSCTSKHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829949-A Compositions for detecting or measuring analytes 伯蒂斯有限公司 2023-09-29 CN disclosed
EP-4101855-B1 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2023-08-02 EP disclosed
EP-3870234-B1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES PHARMA MAR SA (ES) 2022-12-21 EP disclosed
EP-4101855-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2022-12-14 EP disclosed
US-20220193035-A1 INDOLE COMPOUNDS FOR USE IN NEURORESTORATION GALIMEDIX THERAPEUTICS, INC. (US) 2022-06-23 US disclosed
US-10858335-B2 2,3-Disubstituted pyridine compounds as TGF-β inhibitors and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2020-12-08 US disclosed
US-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2019-09-19 US disclosed
US-10233170-B2 2,3-disubstituted pyridine compounds as TGF-beta inhibitors and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2019-03-19 US disclosed
US-9878992-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2018-01-30 US disclosed
US-9878992-B2 GDF-8 inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2018-01-30 US disclosed
US-6235717-B1 Pharmaceutical compounds GLAXO WELLCOME INC. 2001-05-22 US disclosed
EP-1029869-A1 Endothelin converting enzyme inhibitors THE WELLCOME FOUNDATION LIMITED (GB) 2000-08-23 EP disclosed
EP-0677059-A1 ENDOTHELIN CONVERTING ENZYME INHIBITORS THE WELLCOME FOUNDATION LIMITED (GB) 1995-10-18 EP disclosed
US-5382670-A Platelet activating factor antagonists ABBOTT LABORATORIES (US) 1995-01-17 US disclosed
WO-1994015956-A1 ENDOTHELIN CONVERTING ENZYME INHIBITORS THE WELLCOME FOUNDATION LIMITED (GB) 1994-07-21 WO disclosed
EP-0574494-A4 INDOLES USEFUL AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LAB (US) 1994-07-06 EP disclosed
EP-0574494-A1 INDOLES USEFUL AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1993-12-22 EP disclosed
WO-1992014732-A1 INDOLES USEFUL AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1992-09-03 WO disclosed
EP-0499987-A1 Platelet activating factor antagonists ABBOTT LABORATORIES (US) 1992-08-26 EP disclosed
US-5120749-A Treatment of anaphylactic shock, respiratory distress syndrome, acute inflammation, delayed cellulosr immunity, parturtition, fetal lung maturation, and cellular differentiation ABBOTT LABORATORIES (US) 1992-06-09 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 (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-20220193035-A1 INDOLE COMPOUNDS FOR USE IN NEURORESTORATION AANAT, INMT, TPH2 CTSL 2044/4885CTSS 1083/4885CTSK 896/4885
US-10233170-B2 2,3-disubstituted pyridine compounds as TGF-beta inhibitors and methods of use TGFBR1, TGFBR2, ACVR1 CTSL 2340/4885CTSS 2878/4885CTSK 2660/4885
US-10858335-B2 2,3-Disubstituted pyridine compounds as TGF-β inhibitors and methods of use SMAD3, TGFBR1, TGFBR2 CTSL 2097/4885CTSS 2291/4885CTSK 2029/4885
US-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use TGFBR2, ACVR1, TGFBR1 CTSL 1780/4885CTSS 2067/4885CTSK 1868/4885

“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.