SCHEMBL2550398

SCHEMBL2550398

CC(C)(C)OC(=O)N[C@H](CO)Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.48
▸ TSHR P16473 2/20 0.46
▸ AAK1 Q2M2I8 1/20 0.44
▸ CTSL P07711 1/20 0.43
▸ TACR1 P25103 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CTSS P25774 5/20 0.41
▸ CTSK P43235 5/20 0.41
▸ CTSB P07858 2/20 0.41
▸ APP P05067 2/20 0.40
▸ PNMT P11086 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ S1PR3 Q99500 1/20 0.40
▸ ACE P12821 1/20 0.40
▸ VNN1 O95497 1/20 0.39
▸ PCNA P12004 1/20 0.39

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
SCHEMBL2550395 1.00 ATM (0.48) ATMTSHRAAK1CTSLTACR1
SCHEMBL7036933 0.90 ATM (0.46) ATMAAK1CTSLCTSSCTSK
SCHEMBL7036935 0.90 ATM (0.46) ATMAAK1CTSLCTSSCTSK
SCHEMBL5757675 0.89 ATM (0.47) ATMTSHRAAK1CTSLTACR1
SCHEMBL740616 0.88 ATM (0.49) ATMTSHRAAK1CTSLTACR1
SCHEMBL740615 0.88 ATM (0.49) ATMTSHRAAK1CTSLTACR1
SCHEMBL16978180 0.88 TSHR (0.44) ATMTSHRAAK1CTSLSMN1; SMN2
SCHEMBL1519890 0.88 ATM (0.49) ATMTSHRAAK1CTSLTACR1
SCHEMBL29162411 0.87 ATM (0.44) ATMAAK1CTSLCTSSCTSK
SCHEMBL29162409 0.87 ATM (0.44) ATMAAK1CTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 — — US disclosed
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 — — US disclosed
WO-2010083246-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-07-22 — — WO disclosed
EP-1149076-B1 O-THIOCARBAMOYL-AMINOALKANOL COMPOUNDS, THEIR PHARMACEUTICALLY ACCEPTABLE SALTS AND PROCESS FOR PREPARING THE SAME SK CORP (KR) 2003-10-22 — — EP disclosed
EP-1149076-A1 O-THIOCARBAMOYL-AMINOALKANOL COMPOUNDS, THEIR PHARMACEUTICALLY ACCEPTABLE SALTS AND PROCESS FOR PREPARING THE SAME SK Corporation (KR) 2001-10-31 — — EP disclosed
WO-2000046191-A1 O-THIOCARBAMOYL-AMINOALKANOL COMPOUNDS, THEIR PHARMACEUTICALLY ACCEPTABLE SALTS AND PROCESS FOR PREPARING THE SAME SK CORPORATION (KR) 2000-08-10 — — WO disclosed
US-5935997-A O-thiocarbamoyl-aminoalkanol compounds, their pharmaceutically useful salts and process for preparing the same YUKONG LIMITED (KR) 1999-08-10 — — 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 (1 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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE TFEB, PCK2, JAK2 ATM 332/4885TSHR 1392/4885AAK1 588/4885

“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.

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