SCHEMBL116386

SCHEMBL116386

CC(C)(C)OC(=O)NC(C(=O)O)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.66
CTSS P25774 2/20 0.66
ATM Q13315 3/20 0.52
GABRB1 P18505 1/20 0.48
GABRB2 P47870 1/20 0.48
MAPT P10636 1/20 0.48
PPARA Q07869 5/20 0.48
PPARG P37231 4/20 0.48
S1PR3 Q99500 1/20 0.47
ACE P12821 1/20 0.47
PPARD Q03181 2/20 0.46

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
SCHEMBL525862 1.00 CTSK (0.66) CTSKCTSSATMGABRB1GABRB2
SCHEMBL264362 1.00 CTSK (0.66) CTSKCTSSATMGABRB1GABRB2
Hydrochloric Acid SCHEMBL28350663 0.98 CTSK (0.64) CTSKCTSSATMGABRB1GABRB2
Bromide SCHEMBL8184293 0.98 CTSK (0.64) CTSKCTSSATMGABRB1GABRB2
SCHEMBL15671568 0.94 CTSK (0.67) CTSKCTSSATMGABRB1GABRB2
SCHEMBL15671569 0.94 CTSK (0.67) CTSKCTSSATMGABRB1GABRB2
SCHEMBL3759870 0.91 CTSK (0.56) CTSKCTSSATMPPARAPPARG
SCHEMBL27158950 0.91 CTSK (0.56) CTSKCTSSATMPPARAPPARG
SCHEMBL16171655 0.90 CTSK (0.66) CTSKCTSSATMGABRB1GABRB2
SCHEMBL16174111 0.90 CTSK (0.66) CTSKCTSSATMGABRB1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114790178-B Preparation method of oxaagoli sodium 福安药业集团宁波天衡制药有限公司 2024-04-09 CN claimed
CN-104592163-B A kind of synthetic method of chirality 2-Phenylpyrrolidine 爱斯特(成都)生物制药有限公司 2016-08-24 CN claimed
CN-104592163-A Synthetic method of chiral 2-phenylpyrrolidine ASTATECH CHENGDU BIOPHARM CO LTD 2015-05-06 CN claimed
US-12622909-B2 Allosteric EGFR inhibitors and methods of use thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2026-05-12 US disclosed
EP-4721737-A1 USE OF PHARMACEUTICAL COMPOSITION COMPRISING COMPOUND HAVING BIS(AZANYLYLIDENE) SULFONYL STRUCTURE FOR TREATING ANEMIA-RELATED DISEASES Scinnohub Pharmaceutical Co., Ltd. (CN) 2026-04-08 EP disclosed
US-20260000781-A1 FC CONJUGATES INCLUDING AN INHIBITOR OF CD73 AND USES THEREOF CIDARA THERAPEUTICS INC (US) 2026-01-01 US disclosed
WO-2025243042-A1 COMPOUNDS FOR THE INHIBITION OF CYCLOPHILIN D THE UNIVERSITY OF LIVERPOOL (GB) 2025-11-27 WO disclosed
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2025-11-13 US disclosed
US-12435181-B2 Formulations capable of reacting with or removal of molecular oxygen LI SHENSHEN (US) 2025-10-07 US disclosed
US-20250281424-A1 SMALL MOLECULE ANTAGONISTS OF PF4 ZHOU YUHANG (US) 2025-09-11 US disclosed
EP-4551563-A2 FC CONJUGATES INCLUDING AN INHIBITOR OF CD73 AND USES THEREOF CIDARA THERAPEUTICS, INC. (US) 2025-05-14 EP disclosed
US-4039533-A CEPHALOSPORINS PFIZER INC. (US) 1977-08-02 US disclosed
US-4039532-A BACTERICIDES PFIZER INC. (US) 1977-08-02 US disclosed
US-4012380-A 7-Acylamino-3-acyl-2(or 3)cephems ELI LILLY AND COMPANY (US) 1977-03-15 US disclosed
US-3998816-A 7-[5-N-(n-Butoxyethoxy carbonyl and 2-chloroethoxy carbonyl)-amino] cephalosporins C MEIJI SEIKA KAISHA, LTD. (JA) 1976-12-21 US disclosed
US-3989685-A FROM PENICILLIN-1-OXIDE SHINOGI & CO., LTD. (JA) 1976-11-02 US disclosed
US-3988326-A Process for N-acylation of 7 amino cephem compounds MEIJI SEIKA KAISHA, LTD. (JA) 1976-10-26 US disclosed
US-3968226-A 3-Heterocyclic thiomethylcephalosporins as antibacterial agents SMITHKLINE CORPORATION (US) 1976-07-06 US disclosed
US-3966719-A ANTIBACTERIAL PFIZER INC. (US) 1976-06-29 US disclosed
US-3947413-A ANTIBIOTICS MERCK & CO., INC. (US) 1976-03-30 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-12622909-B2 Allosteric EGFR inhibitors and methods of use thereof EGFR, ERBB3, ERBB2 CTSK 2352/4885CTSS 2855/4885ATM 983/4885
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF ROCK1, ROCK2, RHOA CTSK 1192/4885CTSS 2671/4885ATM 1532/4885
US-20250281424-A1 SMALL MOLECULE ANTAGONISTS OF PF4 PF4, F12, F2 CTSK 3949/4885CTSS 3675/4885ATM 2816/4885
US-20260000781-A1 FC CONJUGATES INCLUDING AN INHIBITOR OF CD73 AND USES THEREOF FCGR2A, FCGR1A, FCGR3B CTSK 2406/4885CTSS 1555/4885ATM 4379/4885

“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.