SCHEMBL5890789

SCHEMBL5890789

Sc1cccc(-c2cccc(S)c2S)c1S

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CDC25B P30305 1/20 0.35
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
PSMD14 O00487 1/20 0.33
COPS5 Q92905 1/20 0.33
IDO1 P14902 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CES2 O00748 1/20 0.33
APAF1 O14727 1/20 0.33
TERT O14746 1/20 0.33
NPC1 O15118 1/20 0.33
PLIN1 O60240 1/20 0.33
TDP2 O95551 1/20 0.33
S1PR4 O95977 1/20 0.33
LMNA P02545 1/20 0.33
PLA2G1B P04054 1/20 0.33
BCHE P06276 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL31036021 1.00 MEN1 (0.35) MEN1KMT2ACDC25BMAPTMAPK1
SCHEMBL29109039 0.83 ALDH1A1 (0.39) MEN1KMT2AMAPTMAPK1KDM4E
SCHEMBL30648257 0.83 ALDH1A1 (0.39) MEN1KMT2AMAPTMAPK1KDM4E
SCHEMBL332474 0.82
Benzene SCHEMBL11814356 0.81 ALDH1A1 (0.42) KMT2AMAPTMAPK1HDAC8ALDH1A1
SCHEMBL439094 0.81 ALDH1A1 (0.42) KMT2AMAPTMAPK1HDAC8ALDH1A1
Benzene SCHEMBL27896534 0.81 ALDH1A1 (0.42) KMT2AMAPTMAPK1HDAC8ALDH1A1
Benzene SCHEMBL11823281 0.79 MAPT (0.39) MAPTPSMD14COPS5HDAC8
SCHEMBL11023701 0.77 ALDH1A1 (0.32) IDO1ALDH1A1TSHR
Biphenyl SCHEMBL16581488 0.77 ALDH1A1 (0.41) MEN1KMT2AMAPTMAPK1APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7053173-B2 Polymercaptopolyphenyl and process for preparation thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2006-05-30 US disclosed
US-20040092775-A1 Polymercaptopolyphenyl and process for preparation thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2004-05-13 US disclosed
EP-1380572-A1 POLYMERCAPTOPOLYPHENYLS AND METHOD FOR SYNTHESIS THEREOF Japan Science and Technology Corporation (JP) 2004-01-14 EP disclosed
JP-2003238525-A TERPHENYLDI-, TRI- OR TETRA-THIOL OR THIOLATE AND METHOD FOR SYNTHESIZING THEM JAPAN SCIENCE & TECHNOLOGY CORP 2003-08-27 JP 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-20040092775-A1 Polymercaptopolyphenyl and process for preparation thereof TMT1A, MSMO1, TST MEN1 139/4885KMT2A 1680/4885CDC25B 1935/4885

“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.