SCHEMBL4340567

SCHEMBL4340567

O=C(Cc1cccnc1)Nc1cc2c(-c3ccc4ccccc4c3)n[nH]c2cc1F

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.45
CLK2 P49760 2/20 0.45
CLK3 P49761 2/20 0.45
ROCK2 O75116 1/20 0.45
PARP14 Q460N5 1/20 0.44
WNT1 P04628 4/20 0.42
PSMB8 P28062 1/20 0.42
GSK3B P49841 1/20 0.41
MAPK1 P28482 2/20 0.41
IDO1 P14902 3/20 0.41
FGFR4 P22455 1/20 0.41
AURKA O14965 1/20 0.40
TTK P33981 1/20 0.40
RORC P51449 1/20 0.40

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
SCHEMBL4335929 0.87 DYRK1A (0.46) DYRK1ACLK2CLK3ROCK2PARP14
SCHEMBL2868770 0.81 AURKA (0.51) AURKATTK
SCHEMBL2863485 0.80 CDK4 (0.46) DYRK1AGSK3BMAPK1TTK
SCHEMBL4332486 0.80 KDM4E (0.48) MAPK1
SCHEMBL2867504 0.79 CDK4 (0.45) GSK3BMAPK1
SCHEMBL4340833 0.78 SMN1; SMN2 (0.47) MAPK1
SCHEMBL4334542 0.77 GSK3B (0.53) GSK3B
SCHEMBL4137016 0.76 AURKA (0.58) PARP14PSMB8MAPK1IDO1AURKA
SCHEMBL4137009 0.76 AURKA (0.58) PARP14PSMB8MAPK1IDO1AURKA
SCHEMBL4335912 0.76 CDK9 (0.49) DYRK1ACLK2CLK3ROCK2PARP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 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 (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-20090203691-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 DYRK1A 1216/4885CLK2 334/4885CLK3 223/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 DYRK1A 1216/4885CLK2 334/4885CLK3 223/4885

“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.