SCHEMBL22388587

SCHEMBL22388587

CSc1ccc(C(C)(C)C)c(SC)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.33
MAPT P10636 3/20 0.33
HPN P05981 1/20 0.33
SIRT5 Q9NXA8 1/20 0.33
MCL1 Q07820 1/20 0.33
ALDH1A1 P00352 6/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
KDM4E B2RXH2 2/20 0.31
CYP1A2 P05177 1/20 0.31
ATP2A2 P16615 1/20 0.31
ATP2A3 Q93084 1/20 0.31
TSHR P16473 2/20 0.31
HSD17B10 Q99714 2/20 0.31
GAA P10253 2/20 0.31
HPGD P15428 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL3817345 0.83 MCL1 (0.32) MCL1
SCHEMBL13700994 0.80 MEN1 (0.40) ALOX15MAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL12083464 0.78 ALDH1A1 (0.38) ALOX15MAPTHPNSIRT5MCL1
SCHEMBL21718917 0.77 MAPT (0.32) ALOX15MAPTHPNSIRT5MCL1
SCHEMBL12083400 0.77 KMT2A (0.35) ALOX15MAPTHPNSIRT5MCL1
SCHEMBL12083463 0.77 MAPT (0.32) ALOX15MAPTHPNSIRT5MCL1
SCHEMBL21718799 0.77 MAPT (0.32) ALOX15MAPTHPNSIRT5MCL1
SCHEMBL20888118 0.74 KIF11 (0.41) MAPTALDH1A1KDM4ECYP3A4LMNA
SCHEMBL19753577 0.74 HPGD (0.44) ALOX15ALDH1A1SMN1; SMN2CYP1A2TSHR
SCHEMBL12445297 0.72 HSD17B10 (0.38) ALOX15MAPTHPNSIRT5ALDH1A1

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-20240218027-A1 NUCLEOSIDE TRIPHOSPHATE TRANSPORTER AND USES THEREOF THE SCRIPPS RESEARCH INSTITUTE 2024-07-04 US disclosed
US-20240218027-A1 NUCLEOSIDE TRIPHOSPHATE TRANSPORTER AND USES THEREOF THE SCRIPPS RESEARCH INSTITUTE 2024-07-04 US disclosed
US-11834479-B2 Nucleoside triphosphate transporter and uses thereof THE SCRIPPS RESEARCH INSTITUTE (US) 2023-12-05 US disclosed
US-11834479-B2 Nucleoside triphosphate transporter and uses thereof THE SCRIPPS RESEARCH INSTITUTE (US) 2023-12-05 US disclosed
US-20200277342-A1 NOVEL NUCLEOSIDE TRIPHOSPHATE TRANSPORTER AND USES THEREOF THE SCRIPPS RESEARCH INSTITUTE 2020-09-03 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-20200277342-A1 NOVEL NUCLEOSIDE TRIPHOSPHATE TRANSPORTER AND USES THEREOF SLC35B2, SLC29A2, PNP ALOX15 4229/4885MAPT 2938/4885HPN 1358/4885
US-20240218027-A1 NUCLEOSIDE TRIPHOSPHATE TRANSPORTER AND USES THEREOF SLC35B2, SLC29A2, PNP ALOX15 3991/4885MAPT 2787/4885HPN 1337/4885
US-11834479-B2 Nucleoside triphosphate transporter and uses thereof SLC35B2, SLC29A2, PNP ALOX15 3991/4885MAPT 2787/4885HPN 1337/4885

“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.