SCHEMBL13756307

SCHEMBL13756307

CC(=S)c1c(C)cc(C)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 3/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HPGD P15428 3/20 0.34
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
TAS1R2 Q8TE23 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33

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
SCHEMBL18950230 0.81 CYP3A4 (0.46) KDM4EALDH1A1LMNAMAPTGAA
SCHEMBL29180110 0.80 RAPGEF4 (0.46) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL4953445 0.78 TAS1R3 (0.38) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL13756308 0.77 POLB (0.44) ALDH1A1LMNAMAPTGAACYP1A2
SCHEMBL918994 0.77 RAPGEF4 (0.41) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL2722808 0.77 RAPGEF4 (0.41) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL918995 0.77 RAPGEF4 (0.41) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL6894373 0.76 ALDH1A1 (0.46) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL2848308 0.73 RAPGEF4 (0.43) RAPGEF4KDM4EALDH1A1LMNAMAPT
SCHEMBL698413 0.72 KDM4E (0.46) KDM4EALDH1A1LMNAMAPTL3MBTL1

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-20090209556-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME CORP. 2009-08-20 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-20090209556-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS GUCY1B1, GUCY1A2, GUCY1A1 RAPGEF4 902/4885KDM4E 1970/4885ALDH1A1 2099/4885

“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.