SCHEMBL6991198

SCHEMBL6991198

O=C(Nc1ccccc1S)c1c(Br)sc2c1CCCC2

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
THRB P10828 3/20 0.59
TP53 P04637 3/20 0.52
ANO1 Q5XXA6 8/20 0.51
ANO2 Q9NQ90 4/20 0.51
RXFP1 Q9HBX9 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49
FLT3 P36888 1/20 0.48

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
SCHEMBL6993062 0.87 MAPT (0.59) MAPTTHRBTP53ANO1ANO2
SCHEMBL7000741 0.83 MAPT (0.67) MAPTTHRBTP53ANO1ANO2
SCHEMBL6998812 0.83 MAPT (0.55) MAPTTHRBTP53ANO1ANO2
SCHEMBL6995066 0.76 MAPT (0.55) MAPTTHRBTP53ANO1ANO2
SCHEMBL6992026 0.76 MAPT (0.67) MAPTTHRBTP53ANO1ANO2
SCHEMBL21853900 0.72 ANO1 (0.76) MAPTTP53ANO1ANO2SMN1; SMN2
SCHEMBL21853988 0.70 TP53 (0.79) MAPTTP53ANO1ANO2SMN1; SMN2
SCHEMBL7217418 0.70 CYP1A2 (0.68) MAPTTHRBTP53RXFP1SMN1; SMN2
SCHEMBL6993898 0.69 PTPN1 (0.54) MAPTTHRBNPC1RAB9AMEN1
SCHEMBL19320694 0.68 MEN1 (0.51) MAPTTHRBSMN1; SMN2MEN1ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1016664-B1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2003-07-02 EP disclosed
US-6455521-B1 PSYCHOLOGICAL DISORDERS; SIDE EFFECT REDUCTION MITSUBISHI PHARMA CORPORATION (JP) 2002-09-24 US disclosed
US-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2002-04-11 US disclosed
US-6271225-B1 PSYCHOLOGICAL DISORDERS WELFIDE CORPORATION (JP) 2001-08-07 US disclosed
EP-1016664-A1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-07-05 EP 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-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof ACIN1, ACHE, TPMT MAPT 15/4885THRB 1692/4885TP53 414/4885

“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.