SCHEMBL23564635

SCHEMBL23564635

Cc1cc(C)n(C(=S)SOC(=O)c2ccccc2)n1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 6/20 0.47
ALPL P05186 6/20 0.47
XIAP P98170 6/20 0.47
POLB P06746 1/20 0.47
HSD17B10 Q99714 1/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
TP53 P04637 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
PDE4B Q07343 1/20 0.41
MEN1 O00255 1/20 0.41
ALOX15 P16050 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL23564636 0.90 ALDH1A1 (0.46) ENPP3ALPLXIAPMAPTALDH1A1
SCHEMBL23564634 0.89 ENPP3 (0.60) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564556 0.80 TSHR (0.45) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564551 0.77 TSHR (0.42) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564554 0.77 ALDH1A1 (0.43) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564559 0.76 TSHR (0.46) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564553 0.76 TSHR (0.39) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564563 0.75 ALDH1A1 (0.41) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564641 0.74 POLB (0.41) ENPP3ALPLXIAPPOLBHSD17B10
SCHEMBL23564547 0.74 ALDH1A1 (0.43) ENPP3ALPLXIAPALDH1A1KDM4E

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-11370760-B2 Dithioester compound SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2022-06-28 US disclosed
US-20210188780-A1 DITHIOESTER COMPOUND SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2021-06-24 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 (2 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-11370760-B2 Dithioester compound SQOR, LANCL1, AKR1C4 ENPP3 1752/4885ALPL 2302/4885XIAP 2275/4885
US-20210188780-A1 DITHIOESTER COMPOUND SQOR, LANCL1, AKR1C4 ENPP3 1561/4885ALPL 2218/4885XIAP 2410/4885

“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.