SCHEMBL464624

SCHEMBL464624

CCC1CS(=O)(=O)CC1P

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL1350345 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAHPGDALOX15
SCHEMBL12237083 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAHPGDALOX15
SCHEMBL10109154 0.71 THRB (0.41) ALDH1A1SMN1; SMN2LMNAHPGDALOX15
SCHEMBL10020569 0.68 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2LMNAHPGDALOX15
SCHEMBL13267564 0.68 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2
SCHEMBL24328680 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAHPGDALOX15
SCHEMBL12183703 0.67 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL13078359 0.67 ALDH1A1 (0.41) ALDH1A1LMNA
SCHEMBL12138460 0.66
SCHEMBL19368104 0.64 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2

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-20120065184-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS IRM LLC (BM) 2012-03-15 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-20120065184-A1 COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS TNK2, CNKSR1, BMP2K ALDH1A1 4129/4885SMN1; SMN2 1307/4885LMNA 1004/4885

“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.