SCHEMBL15840648

SCHEMBL15840648

O=S(=O)(Nc1ccccc1)c1ccc(NC(=S)Nc2cc(Cl)ccc2Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
GPR27 Q9NS67 8/20 0.61
AVPR2 P30518 2/20 0.61
LMNA P02545 3/20 0.59
MAPT P10636 2/20 0.59
PPIA P62937 1/20 0.57
HTT P42858 2/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL15840633 0.91 ALDH1A1 (0.71) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL25132396 0.87 ALDH1A1 (0.74) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL15840711 0.87 ALDH1A1 (0.74) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL15840632 0.85 ALDH1A1 (0.74) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL15840806 0.85 ALDH1A1 (0.67) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL5454021 0.84 ALDH1A1 (0.77) ALDH1A1MAPTHTTNPC1RAB9A
SCHEMBL3396831 0.83 ALDH1A1 (0.85) ALDH1A1LMNAMAPTPPIASMN1; SMN2
SCHEMBL15840807 0.83 ALDH1A1 (0.74) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL15840704 0.82 ALDH1A1 (0.63) ALDH1A1GPR27AVPR2LMNAMAPT
SCHEMBL17066583 0.80 GPR27 (0.79) GPR27AVPR2

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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 ALDH1A1 4348/4885GPR27 914/4885AVPR2 4704/4885

“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.