SCHEMBL21995313

SCHEMBL21995313

CSc1nc(-c2ccccc2)c2c(n1)c1ccccc1c(=O)n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.43
LMNA P02545 3/20 0.42
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 1/20 0.40
PDE7A Q13946 3/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP1A2 P05177 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GAA P10253 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
PDE7B Q9NP56 1/20 0.38
JUN P05412 1/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL31347628 1.00 MAPK1 (0.43) MAPK1LMNANPSR1KDM4EPDE7A
SCHEMBL22057630 0.81 MAPK1 (0.46) MAPK1LMNANPSR1KDM4EPDE7A
SCHEMBL22056905 0.80 MAPK1 (0.43) MAPK1LMNANPSR1KDM4EPDE7A
SCHEMBL22056903 0.78 KMT2A (0.43) MAPK1LMNANPSR1KDM4EALDH1A1
SCHEMBL22056901 0.75 MAPK1 (0.43) MAPK1LMNAKDM4EPDE7AALDH1A1
SCHEMBL21995257 0.74 MAPK1 (0.45) MAPK1LMNAKDM4EPDE7ANPC1
SCHEMBL1064871 0.72 KDM4E (0.45) MAPK1LMNANPSR1KDM4ENPC1
SCHEMBL3285141 0.71 KDM4E (0.47) MAPK1NPSR1KDM4EALDH1A1CYP1A2
SCHEMBL15206821 0.68 KMT2A (0.43) MAPK1LMNAKDM4EPDE7AALDH1A1
SCHEMBL24182595 0.68 ALDH1A1 (0.56) MAPK1LMNANPSR1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220013730-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK KGAA (DE) 2022-01-13 US disclosed
EP-3887478-A1 COMPOUNDS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2021-10-06 EP disclosed
WO-2020109434-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-06-04 WO disclosed
WO-2020109434-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-06-04 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 (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-20220013730-A1 COMPOUNDS FOR ELECTRONIC DEVICES ETV6, CYP2C19, ESR1 MAPK1 565/4885LMNA 3208/4885NPSR1 1389/4885

“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.