SCHEMBL5221967

SCHEMBL5221967

COC(=O)CC(NC(=O)OC(C)(C)C)c1ccc(I)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
HTT P42858 2/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
AGTR1 P30556 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CTSS P25774 3/20 0.40
CTSK P43235 2/20 0.40
CYP2D6 P10635 1/20 0.40
PTPRB P23467 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL16680702 1.00 MEN1 (0.41) MEN1POLBKMT2AHTTMAPT
SCHEMBL24440108 1.00 MEN1 (0.41) MEN1POLBKMT2AHTTMAPT
SCHEMBL7227254 0.89 CTSS (0.44) MEN1POLBKMT2AHTTMAPT
SCHEMBL3901269 0.89 CTSS (0.42) MEN1KMT2ANPSR1CTSSCTSK
SCHEMBL24440386 0.89 PPARG (0.43) MEN1POLBKMT2AHTTMAPT
SCHEMBL13118106 0.89 CTSS (0.44) MEN1POLBKMT2AHTTMAPT
SCHEMBL7334591 0.89 CTSS (0.44) MEN1POLBKMT2AHTTMAPT
SCHEMBL16680292 0.88 HTT (0.48) MEN1POLBKMT2AHTTMAPT
SCHEMBL392792 0.88 CACNA1B (0.45) MEN1POLBKMT2AHTTMAPT
SCHEMBL1584639 0.88 MEN1 (0.54) MEN1POLBKMT2AHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9452990-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2016-09-27 US disclosed
EP-2864322-B1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2016-04-27 EP disclosed
US-20150126492-A1 Complement Pathway Modulators and Uses Thereof NOVARTIS AG (CH) 2015-05-07 US disclosed
EP-1814869-A2 SUBSTITUTED AMINO ACIDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS The Institutes for Pharmaceutical Discovery, LLC (US) 2007-08-08 EP disclosed
WO-2006055725-A2 SUBSTITUTED AMINO ACIDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2006-05-26 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 (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-20150126492-A1 Complement Pathway Modulators and Uses Thereof CFB, CFH, TFPI MEN1 1858/4885POLB 2085/4885KMT2A 4794/4885

“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.