SCHEMBL4335950

SCHEMBL4335950

COc1c(NC(=O)[C@H]2CCC(=O)N2)ccc2[nH]nc(-c3cccc(F)c3)c12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
SLC5A1 P13866 2/20 0.38
NTRK1 P04629 2/20 0.37
HPGDS O60760 1/20 0.37
PARP1 P09874 2/20 0.37
CDK9 P50750 1/20 0.36
POLB P06746 1/20 0.36
DYRK1A Q13627 2/20 0.36
CSNK1D P48730 1/20 0.36
CSNK1E P49674 1/20 0.36
PKM P14618 1/20 0.35
TTK P33981 1/20 0.35
MAP2K4 P45985 1/20 0.35

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
SCHEMBL4329118 1.00 MEN1 (0.41) MEN1KMT2ASMN1; SMN2GSK3AGSK3B
SCHEMBL13198269 1.00 MEN1 (0.41) MEN1KMT2ASMN1; SMN2GSK3AGSK3B
SCHEMBL4341112 0.89 MEN1 (0.44) MEN1KMT2ASMN1; SMN2GSK3AGSK3B
SCHEMBL4336504 0.89 MEN1 (0.44) MEN1KMT2ASMN1; SMN2GSK3AGSK3B
SCHEMBL4327628 0.87 GSK3B (0.53) GSK3AGSK3BNTRK1PARP1DYRK1A
SCHEMBL4346834 0.86 SMN1; SMN2 (0.46) MEN1KMT2ASMN1; SMN2GSK3BSLC5A1
SCHEMBL4346877 0.86 SMN1; SMN2 (0.46) MEN1KMT2ASMN1; SMN2GSK3BSLC5A1
SCHEMBL13198283 0.84 GSK3A (0.45) MEN1KMT2ASMN1; SMN2GSK3AGSK3B
SCHEMBL4326338 0.84 GSK3A (0.45) MEN1KMT2ASMN1; SMN2GSK3AGSK3B
SCHEMBL4339882 0.81 GSK3B (0.48) MEN1KMT2ASMN1; SMN2GSK3AGSK3B

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
EP-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP 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 (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-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 MEN1 3782/4885KMT2A 2212/4885SMN1; SMN2 4812/4885

“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.