SCHEMBL14019658

SCHEMBL14019658

O=C1[C@@H]2CSC(c3ccccc3)N2C(=O)[C@@H]2CSC(c3ccccc3)N12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.38
GFER P55789 1/20 0.37
RIPK1 Q13546 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL9771295 0.81 TP53 (0.44) POLBTP53GAAHSD17B10GFER
SCHEMBL11402089 0.80 TP53 (0.38) POLBTP53GAAGFERRIPK1
SCHEMBL17961704 0.80 ADORA2A (0.48) POLBTP53ALDH1A1SMN1; SMN2
SCHEMBL9482020 0.80 ADORA2A (0.48) POLBTP53ALDH1A1SMN1; SMN2
SCHEMBL10774445 0.80 POLB (0.39) POLBTP53GAAALDH1A1HPGD
SCHEMBL9771321 0.80 POLB (0.39) POLBTP53GAAALDH1A1HPGD
SCHEMBL9771359 0.78 POLB (0.39) POLBTP53GAAALDH1A1HPGD
SCHEMBL9826920 0.78 TP53 (0.77) POLBTP53GAAALDH1A1LMNA
SCHEMBL9827212 0.78 GAA (0.77) POLBTP53GAAALDH1A1LMNA
SCHEMBL9771410 0.76 POLB (0.51) POLBTP53GAAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255213-A1 THIAZOLIDINONE AMIDES, THIAZOLIDINE CARBOXYLIC ACID AMIDES, AND SERINE AMIDES, INCLUDING POLYAMINE CONJUGATES THEREOF, AS SELECTIVE ANTI-CANCER AGENTS UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2008-10-16 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-20080255213-A1 THIAZOLIDINONE AMIDES, THIAZOLIDINE CARBOXYLIC ACID AMIDES, AND SERINE AMIDES, INCLUDING POLYAMINE CONJUGATES THEREOF, AS SELECTIVE ANTI-CANCER AGENTS SRM, SAT1, SMS POLB 4520/4885TP53 30/4885GAA 2330/4885

“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.