SCHEMBL2379522

SCHEMBL2379522

CC1(C)OB(c2cnc(Cl)s2)OC1(C)C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.43
LPL P06858 5/20 0.32
LIPG Q9Y5X9 5/20 0.32
P2RX7 Q99572 1/20 0.32
FFAR1 O14842 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL12715453 0.81 USP30 (0.43) USP30LPLLIPGP2RX7FFAR1
Hydrochloric Acid SCHEMBL16936712 0.78 USP30 (0.41) USP30LPLLIPGP2RX7L3MBTL1
SCHEMBL16186833 0.77 USP30 (0.46) USP30FFAR1
SCHEMBL26276543 0.77 USP30 (0.46) USP30P2RX7MAPK1
SCHEMBL2699306 0.77 USP30 (0.43) USP30
SCHEMBL21773957 0.77 USP30 (0.52) USP30
SCHEMBL23390205 0.75 USP30 (0.42) USP30LPLLIPGFFAR1
SCHEMBL22971076 0.75 USP30 (0.40) USP30LPLLIPGFFAR1
SCHEMBL7882060 0.75 USP30 (0.40) USP30P2RX7MAPK1
SCHEMBL14844673 0.74 USP30 (0.47) USP30FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3319943-B1 NITROGEN-CONTAINING HETEROCYCLES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2019-06-26 EP disclosed
US-10239859-B2 Nitrogen-containing heterocycles as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-03-26 US disclosed
US-20180201600-A1 NITROGEN-CONTAINING HETEROCYCLES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-07-19 US disclosed
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US disclosed
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US disclosed
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US disclosed
EP-2550273-A2 PYRROLOPYRAZINE KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2013-01-30 EP disclosed
WO-2011117145-A2 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 WO disclosed
US-20110230462-A1 Pyrrolopyrazine Kinase Inhibitors HENDRICKS ROBERT THAN 2011-09-22 US disclosed
US-20110230462-A1 Pyrrolopyrazine Kinase Inhibitors HENDRICKS ROBERT THAN 2011-09-22 US disclosed
US-20110230462-A1 Pyrrolopyrazine Kinase Inhibitors HENDRICKS ROBERT THAN 2011-09-22 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 (3 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-20110230462-A1 Pyrrolopyrazine Kinase Inhibitors SYK, ZAP70, BTK USP30 1194/4885LPL 4542/4885LIPG 3995/4885
US-20180201600-A1 NITROGEN-CONTAINING HETEROCYCLES AS PESTICIDES DDT, DNPH1, PTMS USP30 2991/4885LPL 4562/4885LIPG 4630/4885
US-10239859-B2 Nitrogen-containing heterocycles as pesticides DDT, DNPH1, PTMS USP30 2991/4885LPL 4562/4885LIPG 4630/4885

“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.