SCHEMBL2436787

SCHEMBL2436787

BO.c1csc(-c2cccs2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 3/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 3/20 0.50
DPP4 P27487 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 2/20 0.48
GAA P10253 2/20 0.48
GLA P06280 1/20 0.48
NPC1 O15118 2/20 0.47
POLB P06746 2/20 0.47
RAB9A P51151 2/20 0.47
HSD17B10 Q99714 2/20 0.47
TP53 P04637 1/20 0.47
NFKB1 P19838 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47

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
SCHEMBL16291133 0.90 L3MBTL1 (0.57) L3MBTL1ALDH1A1KDM4EMAPTMEN1
SCHEMBL3545 0.90 L3MBTL1 (0.57) L3MBTL1ALDH1A1KDM4EMAPTMEN1
SCHEMBL30398774 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
Bromide SCHEMBL29519314 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
SCHEMBL29776515 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
Ammonia Solution, Strong SCHEMBL34467257 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
Benzene SCHEMBL28420098 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
Bromide SCHEMBL30467088 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
Hydrogen Sulfide SCHEMBL22588115 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1
Fluoride SCHEMBL491501 0.87 L3MBTL1 (0.55) L3MBTL1ALDH1A1KDM4EMAPTMEN1

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
US-8853424-B2 Protein cross-linking inhibitor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-10-07 US disclosed
US-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-09-01 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-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR BAZ2B, PRMT1, BRIX1 L3MBTL1 1358/4885ALDH1A1 4540/4885KDM4E 1022/4885

“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.