SCHEMBL4335955

SCHEMBL4335955

COc1c(C(=O)NCCCN2CCCC2=O)ccc2[nH]nc(-c3ccc4ccccc4c3)c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.45
NPC1 O15118 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TYRO3 Q06418 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
MET P08581 1/20 0.43

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
SCHEMBL4335954 0.88 L3MBTL1 (0.51) RCE1L3MBTL1KDM4EALDH1A1GAA
SCHEMBL4348188 0.86 L3MBTL1 (0.51) RCE1L3MBTL1KDM4EALDH1A1HPGD
SCHEMBL4332582 0.86 L3MBTL1 (0.51) RCE1L3MBTL1KDM4EALDH1A1GAA
SCHEMBL13635355 0.84 KDM4E (0.42) KDM4EALDH1A1HPGDTSHRLMNA
SCHEMBL13198250 0.83 HDAC6 (0.50) TSHRLMNACYP1A2
SCHEMBL4348178 0.81 LMNA (0.45) MAPK1LMNA
SCHEMBL6444431 0.81 RCE1 (0.51) RCE1L3MBTL1KDM4EALDH1A1GAA
SCHEMBL4331810 0.79 KDR (0.42) KDM4EALDH1A1HPGDMAPK1LMNA
SCHEMBL2864362 0.78 GSK3B (0.44)
SCHEMBL4341000 0.77 NPC1 (0.51) RCE1L3MBTL1KDM4EALDH1A1GAA

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 RCE1 1933/4885L3MBTL1 2399/4885KDM4E 2531/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 RCE1 1933/4885L3MBTL1 2399/4885KDM4E 2531/4885

“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.