SCHEMBL382154

SCHEMBL382154

Clc1nccc2[nH]nc(C3CC3)c12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FYN P06241 2/20 0.35
LRRK2 Q5S007 13/20 0.35
GRM4 Q14833 2/20 0.33
BRD4 O60885 2/20 0.31
GAA P10253 1/20 0.31
TRIM24 O15164 1/20 0.31
BRD2 P25440 1/20 0.31
KMT2A Q03164 1/20 0.31
BRD3 Q15059 1/20 0.31
CREBBP Q92793 1/20 0.31

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
SCHEMBL30228567 1.00 FYN (0.35) FYNLRRK2GRM4BRD4GAA
SCHEMBL10224611 0.95 LRRK2 (0.35) FYNLRRK2GRM4
SCHEMBL883290 0.92 LRRK2 (0.37) LRRK2GRM4KMT2A
SCHEMBL25256478 0.86 LRRK2 (0.36) LRRK2
SCHEMBL25747927 0.78 LRRK2 (0.34) LRRK2GRM4
SCHEMBL26632933 0.76 GAA (0.37) LRRK2GRM4BRD4GAA
SCHEMBL30228553 0.73
SCHEMBL24168878 0.73
SCHEMBL876184 0.73 LRRK2 (0.62) LRRK2
SCHEMBL13190155 0.73 GAA (0.35) LRRK2GRM4BRD4GAABRD2

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12565497-B2 Sulfone derivatives HOFFMANN-LA ROCHE INC. (US) 2026-03-03 US disclosed
US-20230219953-A1 SULFONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-07-13 US disclosed
US-20230219953-A1 SULFONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-07-13 US disclosed
US-20230219953-A1 SULFONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-07-13 US disclosed
CN-115916756-A Sulfone derivative 豪夫迈·罗氏有限公司 2023-04-04 CN disclosed
WO-2021259831-A1 SULFONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2021-12-30 WO disclosed
US-20170320870-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2017-11-09 US disclosed
US-20170320870-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2017-11-09 US disclosed
US-20170320870-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2017-11-09 US disclosed
EP-2408772-B1 COMPOUNDS MEDICAL RES COUNCIL TECHNOLOGY (GB) 2015-07-01 EP disclosed
US-8569281-B2 Compounds and their administration for treating a neurodegenerative disease as well as a method for identifying a compound capable of inhibiting a kinase, such as LRRK MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2013-10-29 US disclosed
US-20120295883-A1 COMPOUNDS GENENTECH, INC. (US) 2012-11-22 US disclosed
US-20120295883-A1 COMPOUNDS GENENTECH, INC. (US) 2012-11-22 US disclosed
US-20120295883-A1 COMPOUNDS GENENTECH, INC. (US) 2012-11-22 US disclosed
WO-2012038743-A1 PYRAZOLOPYRIDINES AS INHIBITORS OF THE KINASE LRRK2 MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2012-03-29 WO disclosed
EP-2408772-A1 COMPOUNDS Medical Research Council Technology (GB) 2012-01-25 EP disclosed
US-20100317646-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-12-16 US disclosed
US-20100317646-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-12-16 US disclosed
US-20100317646-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-12-16 US disclosed
WO-2010106333-A1 COMPOUNDS MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-09-23 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 (5 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-20230219953-A1 SULFONE DERIVATIVES SULT1E1, SULT1A1, SULT2A1 FYN 1846/4885LRRK2 2930/4885GRM4 1727/4885
US-20120295883-A1 COMPOUNDS ABCC5, PRNP, PC FYN 317/4885LRRK2 1512/4885GRM4 1526/4885
US-20170320870-A1 COMPOUNDS CBR3, CNR1, HCAR3 FYN 1103/4885LRRK2 2309/4885GRM4 1109/4885
US-20100317646-A1 COMPOUNDS CBR3, CNR1, HCAR3 FYN 1138/4885LRRK2 2208/4885GRM4 1107/4885
US-12565497-B2 Sulfone derivatives CXCR1, CCR1, SULT1E1 FYN 1594/4885LRRK2 2952/4885GRM4 1606/4885

“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.