SCHEMBL7520847

SCHEMBL7520847

C/C(=C\CS(=O)(=O)c1ccccc1)CBr

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.47
POLB P06746 1/20 0.45
ALDH1A1 P00352 3/20 0.44
TP53 P04637 2/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HSD11B1 P28845 6/20 0.42
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
S1PR2 O95136 1/20 0.41
LMNA P02545 1/20 0.41
PRNP P04156 1/20 0.41
XBP1 P17861 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
BCAT1 P54687 1/20 0.39
TSHR P16473 1/20 0.36

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
SCHEMBL7520850 1.00 PSIP1 (0.47) PSIP1POLBALDH1A1TP53HTT
SCHEMBL7758181 0.86 PSIP1 (0.50) PSIP1POLBALDH1A1TP53HTT
SCHEMBL7758178 0.86 PSIP1 (0.50) PSIP1POLBALDH1A1TP53HTT
SCHEMBL7511105 0.85 CTSK (0.50) ALDH1A1TP53MAPTKMT2AMEN1
SCHEMBL7511102 0.85 CTSK (0.50) ALDH1A1TP53MAPTKMT2AMEN1
SCHEMBL8251533 0.84 PSIP1 (0.53) PSIP1POLBALDH1A1TP53HTT
SCHEMBL8231248 0.83 PSIP1 (0.47) PSIP1POLBALDH1A1TP53HTT
SCHEMBL11066021 0.83 PSIP1 (0.47) PSIP1POLBALDH1A1TP53HTT
SCHEMBL7758163 0.82 PSIP1 (0.54) PSIP1POLBALDH1A1TP53HTT
SCHEMBL1071266 0.79 MAPT (0.47) PSIP1POLBALDH1A1HSD17B10MAPT

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
EP-1231197-A1 Process for producing allyl halide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-08-14 EP disclosed
US-20020107422-A1 Process for producing allyl halide compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2002-08-08 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-20020107422-A1 Process for producing allyl halide compound ENY2, ZYX, RPS4Y1 PSIP1 3405/4885POLB 1644/4885ALDH1A1 1133/4885

“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.