SCHEMBL6406967

SCHEMBL6406967

CCCCC[S].CCCC[S]

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
THRB P10828 1/20 0.50
LMNA P02545 3/20 0.43
SLC22A1 O15245 3/20 0.39
SLC22A2 O15244 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DNM1 Q05193 5/20 0.37
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL37854 0.96
SCHEMBL129166 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL77259 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL1609996 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL55416 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL451731 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL1610728 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL1611286 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL1612921 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1
SCHEMBL371663 0.92 TSHR (0.61) TSHRTHRBLMNASLC22A1DNM1

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-20050261371-A1 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. 2005-11-24 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 (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-20050261371-A1 Pentanoic acid derivatives FFAR3, FFAR1, HCAR3 TSHR 65/4885THRB 421/4885LMNA 3496/4885

“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.