SCHEMBL4745019

SCHEMBL4745019

Cc1nccc(C(O)=S)n1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.39
SORT1 Q99523 4/20 0.33
KDM4E B2RXH2 3/20 0.33
LMNA P02545 1/20 0.33
PIK3C3 Q8NEB9 3/20 0.33
KDM5A P29375 1/20 0.32
JMJD1C Q15652 1/20 0.32
KDM3A Q9Y4C1 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
POLB P06746 1/20 0.31
MAPK8 P45983 1/20 0.30
ALOX15 P16050 1/20 0.30

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
Potassium SCHEMBL6986956 0.98 GRM4 (0.38) GRM4SORT1KDM4ELMNAPIK3C3
SCHEMBL6501033 0.78 GRM4 (0.39) GRM4SORT1KDM4ELMNAPIK3C3
SCHEMBL1578942 0.78 KDM4E (0.53) GRM4SORT1KDM4ELMNAKDM5A
SCHEMBL7068952 0.78 ALDH1A1 (0.33) GRM4SORT1KDM4ELMNAPIK3C3
SCHEMBL27801110 0.77 KDM4E (0.52) GRM4SORT1KDM4ELMNAPIK3C3
Ammonia Solution, Strong SCHEMBL27766041 0.77 KDM4E (0.52) GRM4SORT1KDM4ELMNAPIK3C3
SCHEMBL6989840 0.75 CYP1A2 (0.37) GRM4KDM4ELMNAPIK3C3ALDH1A1
SCHEMBL882664 0.74 ALDH1A1 (0.47) GRM4SORT1KDM4ELMNAPIK3C3
SCHEMBL2829062 0.72 ADORA3 (0.41) SORT1KDM4ELMNAKDM5AJMJD1C
SCHEMBL14192611 0.72 SORT1 (0.39) GRM4SORT1KDM4ELMNAPIK3C3

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-20080293711-A1 Chemokine receptor modulators METASTATIX, INC. 2008-11-27 US disclosed
WO-2008112156-A1 CHEMOKINE RECEPTOR MODULATORS ALTIRIS THERAPEUTICS (US) 2008-09-18 WO 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-20080293711-A1 Chemokine receptor modulators CCR5, CCL2, CXCR4 GRM4 1024/4885SORT1 3810/4885KDM4E 4332/4885

“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.