SCHEMBL2140318

SCHEMBL2140318

CCN(C(C)C(=O)OC(C)(C)C)[C@@H](C)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
SYK P43405 1/20 0.47
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
NTSR1 P30989 1/20 0.40

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
SCHEMBL2708989 1.00 POLB (0.48) POLBSYKALDH1A1SMN1; SMN2GAA
SCHEMBL20272638 0.84 ALDH1A1 (0.50) ALDH1A1
SCHEMBL30863382 0.81 ABCB1 (0.49) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL30878162 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL19456479 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2NTSR1
SCHEMBL30307663 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL2499502 0.81 POLB (0.47) POLBSYKALDH1A1SMN1; SMN2
SCHEMBL2136696 0.81 POLB (0.46) POLBSYKALDH1A1GAANTSR1
SCHEMBL2138277 0.81 POLB (0.46) POLBSYKALDH1A1GAANTSR1
SCHEMBL12345526 0.80 ALDH1A1 (0.51) POLBSYKALDH1A1

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-20120101137-A1 NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2012-04-26 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-20120101137-A1 NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF GCK, GCKR, HK2 POLB 4068/4885SYK 1989/4885ALDH1A1 2623/4885

“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.