SCHEMBL18173741

SCHEMBL18173741

O=S1(=O)Cc2ccccc2Nc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.65
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
NOX1 Q9Y5S8 1/20 0.55
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
AHR P35869 1/20 0.42
PDK2 Q15119 1/20 0.42
NPC1 O15118 2/20 0.41
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
MAPK14 Q16539 1/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL18173744 0.82 PLCG1 (0.53) PLCG1KMT2AMEN1NOX1CA12
SCHEMBL18173666 0.79 PLCG1 (0.45) PLCG1KMT2AMEN1NOX1SRC
SCHEMBL18173621 0.79 PLCG1 (0.53) PLCG1KMT2AMEN1NOX1SRC
SCHEMBL88748 0.78 PLCG1 (1.00) PLCG1KMT2AMEN1NOX1CA12
SCHEMBL88913 0.77 PLCG1 (0.65) PLCG1KMT2AMEN1NOX1CA12
SCHEMBL13938220 0.73 PLCG1 (0.59) PLCG1KMT2AMEN1NOX1CA12
SCHEMBL29489792 0.72 KMT2A (1.00) PLCG1KMT2AMEN1NOX1CA12
SCHEMBL1021854 0.72 KMT2A (1.00) PLCG1KMT2AMEN1NOX1CA12
SCHEMBL20644286 0.69 PLCG1 (0.41) PLCG1KMT2AMEN1CA12CA1
SCHEMBL9001235 0.69 NOTUM (0.50) PLCG1KMT2AMEN1MAPTKDM4E

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-3250035-B1 COMPOUNDS AND THEIR USE AS BACE1 INHIBITORS ALLGENESIS BIOTHERAPEUTICS INC (TW) 2023-01-25 EP disclosed
US-10870635-B2 Compounds and their use as BACE1 inhibitors ALLGENESIS BIOTHERAPEUTICS, INC. (TW) 2020-12-22 US disclosed
US-20180201604-A1 COMPOUNDS AND THEIR USE AS BACE1 INHIBITORS ALLGENESIS BIOTHERAPEUTICS, INC. (TW) 2018-07-19 US disclosed
EP-3250035-A1 COMPOUNDS AND THEIR USE AS BACE1 INHIBITORS Allgenesis Biotherapeutics Inc. (TW) 2017-12-06 EP disclosed
WO-2016172255-A1 COMPOUNDS AND THEIR USE AS BACE1 INHIBITORS ALLGENESIS BIOTHERAPEUTICS, INC. (TW) 2016-10-27 WO 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 (2 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-10870635-B2 Compounds and their use as BACE1 inhibitors BACE1, BACE2, APP PLCG1 3539/4885KMT2A 3744/4885MEN1 1510/4885
US-20180201604-A1 COMPOUNDS AND THEIR USE AS BACE1 INHIBITORS BACE1, BACE2, APP PLCG1 3592/4885KMT2A 3811/4885MEN1 1461/4885

“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.