SCHEMBL23709259

SCHEMBL23709259

O=c1n(-c2ccccc2)c2c3ccccc3c3ccccc3c2n1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.61
GSK3A P49840 5/20 0.50
GSK3B P49841 5/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
KDM4E B2RXH2 2/20 0.48
ATM Q13315 1/20 0.48
PGR P06401 3/20 0.47
GAA P10253 2/20 0.46
MAPK8 P45983 2/20 0.46
MAPK9 P45984 1/20 0.46
NPSR1 Q6W5P4 2/20 0.44
MEN1 O00255 1/20 0.42
QSOX1 O00391 1/20 0.42
RGS12 O14924 1/20 0.42
PMM2 O15305 1/20 0.42
PLIN1 O60240 1/20 0.42
GMNN O75496 1/20 0.42
BBOX1 O75936 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL18020094 0.86 MAPK1 (0.68) MAPK1GSK3AGSK3BL3MBTL1KDM4E
SCHEMBL881155 0.84 L3MBTL1 (0.57) MAPK1L3MBTL1KDM4EATMPGR
SCHEMBL12251851 0.83 ALDH1A1 (0.50) MAPK1ATMGAAMEN1ALDH1A1
SCHEMBL1722780 0.80 GSK3B (0.71) MAPK1GSK3AGSK3BL3MBTL1KDM4E
SCHEMBL14933357 0.74 MAPK1 (0.61) MAPK1L3MBTL1KDM4EATMPGR
SCHEMBL6362698 0.73 GSK3A (0.56) MAPK1GSK3AGSK3BL3MBTL1KDM4E
SCHEMBL17108164 0.73 MAPK1 (0.55) MAPK1GSK3AGSK3BL3MBTL1KDM4E
SCHEMBL30286748 0.73 L3MBTL1 (0.74) MAPK1L3MBTL1KDM4EATMPGR
SCHEMBL127119 0.73 L3MBTL1 (0.74) MAPK1L3MBTL1KDM4EATMPGR
SCHEMBL6362495 0.72 PGR (0.71) MAPK1GSK3AGSK3BL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230139809-A1 BENZIMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2023-05-04 US disclosed
US-20230139809-A1 BENZIMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2023-05-04 US disclosed
WO-2021151922-A1 BENZIMIDAZOLE DERIVATIVES MERCK PATENT GMBH (DE) 2021-08-05 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-20230139809-A1 BENZIMIDAZOLE DERIVATIVES ECI1, COX4I1, BRD4 MAPK1 3850/4885GSK3A 3260/4885GSK3B 3043/4885

“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.