SCHEMBL11989395

SCHEMBL11989395

CCOC(=O)NCNC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 3/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
CA1 P00915 4/20 0.41
CA12 O43570 3/20 0.41
CA2 P00918 3/20 0.41
CA9 Q16790 2/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CA7 P43166 2/20 0.39
CA14 Q9ULX7 1/20 0.39
CTSK P43235 2/20 0.38
EPHX1 P07099 1/20 0.38

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
SCHEMBL11989021 0.87 TDP1 (0.55) TDP1MEN1KMT2AGAAHTT
SCHEMBL7618800 0.85 GAA (0.50) KMT2AALDH1A1TSHRGAACYP1A2
SCHEMBL1936376 0.80 ALDH1A1 (0.52) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL15503279 0.80 GAA (0.38) KMT2AALDH1A1TSHRGAAHTT
SCHEMBL13652516 0.80 TDP1 (0.46) TDP1MEN1KMT2AGAACA1
SCHEMBL4240132 0.79 MEN1 (0.46) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL343190 0.79 CYP1A2 (0.44) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL3403411 0.79 APLNR (0.49) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL12721463 0.79 TDP1 (0.48) TDP1MEN1KMT2AGAAHTT
SCHEMBL13590792 0.79 KMT2A (0.49) MEN1KMT2AALDH1A1TSHRCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8246991-B2 Biocompatible and biodegradable elastomeric polymers SURMODICS PHARMACEUTICALS, INC. (US) 2012-08-21 US disclosed
US-20100003305-A1 BIOCOMPATIBLE AND BIODEGRADABLE ELASTOMERIC POLYMERS EVONIK OPERATIONS GMBH (DE) 2010-01-07 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-20100003305-A1 BIOCOMPATIBLE AND BIODEGRADABLE ELASTOMERIC POLYMERS ECPAS, FN1, DDR1 TDP1 1878/4885MEN1 2344/4885KMT2A 4005/4885

“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.