SCHEMBL638155

SCHEMBL638155

Cc1ncc2c(c1OC(=O)OC(C)I)COC2c1ccc(Cl)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.31
KMT2A Q03164 1/20 0.31
TP53 P04637 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL636691 0.92 MAPT (0.32) MAPTKMT2A
SCHEMBL638386 0.90 MAPT (0.35) MAPTKMT2AGAA
SCHEMBL3488951 0.90 MAPT (0.35) MAPTKMT2AGAA
SCHEMBL3491675 0.86 MAPT (0.33) MAPTKMT2A
SCHEMBL3490683 0.85 ABCC1 (0.38) MAPTKMT2ATP53GAA
SCHEMBL638387 0.85 MAPT (0.36) MAPTKMT2A
SCHEMBL9662398 0.85 MAPT (0.36) MAPTKMT2A
SCHEMBL3488954 0.85 MAPT (0.36) MAPTKMT2A
SCHEMBL3490680 0.84 MAPT (0.32) MAPTKMT2A
SCHEMBL637947 0.84 MAPT (0.34) MAPTKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2326652-B1 NITRO DERIVATIVES OF FURASEMIDE AND THEIR USE AS DIURETICS MERCK SHARP & DOHME (US) 2014-04-16 EP disclosed
US-8119806-B2 Cicletanine derivatives MERCK SHARP & DOHME CORP. (US) 2012-02-21 US disclosed
US-20100029678-A1 DIURETICS MERCK SHARP & DOHME CORP. 2010-02-04 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-20100029678-A1 DIURETICS NR3C2, REN, NR3C1 MAPT 4222/4885KMT2A 1778/4885TP53 4370/4885

“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.