SCHEMBL4332595

SCHEMBL4332595

Cc1cc(NC(=O)[C@@H]2CCC(=O)N2)cc2c(-c3cccc(F)c3)n[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.45
HPGDS O60760 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
EGFR P00533 1/20 0.39
CDK9 P50750 1/20 0.38
SLC5A1 P13866 1/20 0.38
CSNK1D P48730 1/20 0.38
CSNK1E P49674 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A2 O94788 1/20 0.37
WNT1 P04628 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
SCHEMBL4343149 1.00 PARP1 (0.45) PARP1HPGDSMEN1KMT2ASMN1; SMN2
SCHEMBL4341168 0.92 HPGDS (0.44) PARP1HPGDSMEN1KMT2ASMN1; SMN2
SCHEMBL4341030 0.92 HPGDS (0.44) PARP1HPGDSMEN1KMT2ASMN1; SMN2
SCHEMBL4341417 0.85 GSK3A (0.55) MEN1KMT2APOLBGSK3AGSK3B
SCHEMBL2868379 0.80 TTK (0.47) GSK3AGSK3B
SCHEMBL4338783 0.80 KDM4E (0.51) MEN1KMT2ASMN1; SMN2POLBHSD17B10
SCHEMBL4332106 0.80 MAPK10 (0.47) POLBGSK3AGSK3BWNT1
SCHEMBL4333966 0.79 MEN1 (0.46) PARP1HPGDSMEN1KMT2ASMN1; SMN2
SCHEMBL4331235 0.79 MEN1 (0.46) PARP1HPGDSMEN1KMT2ASMN1; SMN2
SCHEMBL4348193 0.79 GSK3B (0.48) PARP1HPGDSMEN1KMT2ASMN1; SMN2

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 7 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
EP-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP 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 PARP1 2269/4885HPGDS 3040/4885MEN1 3782/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 PARP1 2269/4885HPGDS 3040/4885MEN1 3782/4885

“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.