SCHEMBL19196342

SCHEMBL19196342

C/C=C\Cn1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TK1 P04183 14/20 0.62
TK2 O00142 1/20 0.56
MAPK1 P28482 1/20 0.53
HPGD P15428 1/20 0.51

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
SCHEMBL9891076 1.00 TK1 (0.62) TK1TK2MAPK1HPGD
SCHEMBL19181903 0.83 TK1 (0.63) TK1TK2MAPK1
SCHEMBL6714052 0.82 TK1 (0.57) TK1TK2MAPK1HPGD
SCHEMBL9891079 0.81 GRIA1 (0.47) TK1TK2
SCHEMBL9891078 0.81 LMNA (0.51) TK1TK2
SCHEMBL9891080 0.81 ALDH1A1 (0.47) TK1MAPK1
SCHEMBL9021896 0.81 TK1 (0.56) TK1TK2MAPK1HPGD
SCHEMBL17478575 0.80 TK1 (0.59) TK1TK2MAPK1
SCHEMBL19182471 0.79 TK1 (0.62) TK1TK2
SCHEMBL19182467 0.79 TK1 (0.62) TK1TK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10940150-B2 Thymine derivatives and quinazoline-dione derivatives for the inhibition of HSP27 TECHNISCHE UNIVERSITAET DRESDEN (DE) 2021-03-09 US disclosed
US-20180207160-A1 THYMINE DERIVATIVES AND QUINAZOLINE-DIONE DERIVATIVES FOR THE INHIBITION OF HSP27 TECHNISCHE UNIVERSITAET DRESDEN (DE) 2018-07-26 US disclosed
US-20170216297-A1 EFFICIENT INHIBITION OF HSP27 TECHNISCHE UNIVERSITAET DRESDEN (DE) 2017-08-03 US disclosed
US-20170216297-A1 EFFICIENT INHIBITION OF HSP27 TECHNISCHE UNIVERSITAET DRESDEN (DE) 2017-08-03 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 (3 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-20180207160-A1 THYMINE DERIVATIVES AND QUINAZOLINE-DIONE DERIVATIVES FOR THE INHIBITION OF HSP27 HSPB1, HSP90B1, HSP90AB1 TK1 213/4885TK2 898/4885MAPK1 583/4885
US-20170216297-A1 EFFICIENT INHIBITION OF HSP27 HSPB1, HSP90AB2P, HSP90B1 TK1 710/4885TK2 243/4885MAPK1 896/4885
US-10940150-B2 Thymine derivatives and quinazoline-dione derivatives for the inhibition of HSP27 HSPB1, HSP90B1, HSP90AB1 TK1 213/4885TK2 898/4885MAPK1 583/4885

“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.