SCHEMBL989453

SCHEMBL989453

COC(=O)c1ccc([C@H](CO)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPT P10636 2/20 0.41
GPR88 Q9GZN0 1/20 0.40
CYP4A11 Q02928 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
ATM Q13315 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
CYP4F2 P78329 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
SCHEMBL30109148 1.00 RIPK1 (0.42) RIPK1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL31269590 0.88 CYP3A4 (0.40) CYP3A4CYP2C9TSHRCYP2C19MAPT
SCHEMBL31269567 0.88 LOXL2 (0.45) CYP3A4CYP2C9TSHRCYP2C19MAPT
SCHEMBL30109275 0.88 LOXL2 (0.45) CYP3A4CYP2C9TSHRCYP2C19MAPT
SCHEMBL30109188 0.87 MAPT (0.47) RIPK1MAPTGPR88ATMCTSS
SCHEMBL21715575 0.87 CYP4A11 (0.46) CYP3A4CYP2C9TSHRCYP2C19MAPT
SCHEMBL2793090 0.86 CYP2D6 (0.44) CYP3A4CYP2C9TSHRCYP2C19MAPT
SCHEMBL2791088 0.86 ATM (0.41) CYP3A4CYP2C9TSHRCYP2C19MAPT
SCHEMBL5151480 0.86 ATM (0.46) TSHRMAPTATMCTSSCTSK
SCHEMBL15875951 0.86 ALDH1A1 (0.47) RIPK1TSHRCYP2C19MAPTGPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4561575-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 EP disclosed
US-20240360103-A1 COMPLEMENT INHIBITION SIXTH STREET LENDING PARTNERS 2024-10-31 US disclosed
WO-2023278698-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2023-01-05 WO disclosed
US-8598355-B2 Amide compound ASTELLAS PHARMA INC. (JP) 2013-12-03 US disclosed
EP-2565191-A1 4-(Indol-7-ylcarbonylaminomethyl)cyclohexanecarboxylic acid derivatives as EP4 receptor antagonists useful for the treatment of chronic renal failure or diabetic nephropathy Astellas Pharma Inc. (JP) 2013-03-06 EP disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP disclosed
WO-2009139373-A1 AMIDE COMPOUND アステラス製薬株式会社 (JP) 2009-11-19 WO 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 (2 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-20110144153-A1 AMIDE COMPOUND PTGER4, PTGER1, PTGER2 RIPK1 1730/4885CYP3A4 2268/4885CYP2C9 3223/4885
US-20240360103-A1 COMPLEMENT INHIBITION C5, C9, C1QBP RIPK1 4348/4885CYP3A4 4017/4885CYP2C9 3832/4885

“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.