SCHEMBL20159340

SCHEMBL20159340

Cn1nc(Br)nc1Oc1cccc(F)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
HTR1A P08908 2/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34
HTR6 P50406 1/20 0.34
DHPS P49366 1/20 0.33
PIN1 Q13526 1/20 0.32
RHEB Q15382 1/20 0.32
AMY1A P0DUB6 1/20 0.32
HIF1A Q16665 1/20 0.31
CCR4 P51679 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 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
SCHEMBL23504846 0.83 DHPS (0.36) MEN1MAPTKMT2ALMNAHTR1A
SCHEMBL20138851 0.83 GCK (0.36) MEN1MAPTKMT2ALMNAHTR1A
SCHEMBL20138658 0.83 HTR1A (0.32) MAPTHTR1ADRD2HTR2AHTR7
SCHEMBL6916024 0.80 KMT2A (0.41) MEN1MAPTKMT2ALMNAHTR1A
SCHEMBL3789597 0.73 HSD11B1 (0.40) MEN1MAPTKMT2ALMNAHTR1A
SCHEMBL20138791 0.72 KDR (0.41) MAPTHTR2ASLC6A4
SCHEMBL20138711 0.71 KDM4E (0.39) MAPTHTR1ASLC6A2SLC6A4KDM4E
SCHEMBL14920786 0.71 SLC6A2 (0.46) HTR1ARHEBSLC6A2SLC6A4SLC6A3
SCHEMBL20142975 0.68 MAPT (0.39) MEN1MAPTKMT2ALMNAPIN1
SCHEMBL20139332 0.68 EPAS1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109790149-B Phenoxytriazoles 豪夫迈·罗氏有限公司 2022-05-17 CN disclosed
US-11319314-B2 Phenoxytriazoles HOFFMANN-LA ROCHE INC. (US) 2022-05-03 US disclosed
US-11319314-B2 Phenoxytriazoles HOFFMANN-LA ROCHE INC. (US) 2022-05-03 US disclosed
US-20210309653-A1 PHENOXYTRIAZOLES HOFFMANN-LA ROCHE INC. (US) 2021-10-07 US disclosed
US-20210309653-A1 PHENOXYTRIAZOLES HOFFMANN-LA ROCHE INC. (US) 2021-10-07 US disclosed
EP-3538516-B1 PHENOXYTRIAZOLES HOFFMANN LA ROCHE (CH) 2021-06-16 EP disclosed
EP-3538516-B1 PHENOXYTRIAZOLES HOFFMANN LA ROCHE (CH) 2021-06-16 EP disclosed
WO-2018087018-A1 PHENOXYTRIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2018-05-17 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-20210309653-A1 PHENOXYTRIAZOLES HTT, PSEN1, APP MEN1 1761/4885MAPT 93/4885KMT2A 637/4885
US-11319314-B2 Phenoxytriazoles HTT, APP, PSEN1 MEN1 1865/4885MAPT 84/4885KMT2A 792/4885

“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.