SCHEMBL4335961

SCHEMBL4335961

COc1c(C(=O)O)ccc2c1c(-c1cccc(F)c1)nn2C(CC(N)=O)N1CCCC1=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 4/20 0.33
CSNK1D P48730 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
TRPA1 O75762 1/20 0.31
EGFR P00533 1/20 0.31
HTT P42858 1/20 0.30
ADORA1 P30542 2/20 0.30
DCAF1 Q9Y4B6 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
DCLRE1B Q9H816 1/20 0.30
ICMT O60725 1/20 0.30
CTSA P10619 2/20 0.30
PTPN1 P18031 1/20 0.30

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
SCHEMBL4341005 0.90 CSNK1E (0.34) CSNK1ECSNK1DEGFRADORA1DCAF1
SCHEMBL4335958 0.88 PIK3CD (0.34) KDM4EALDH1A1LMNAEGFRCTSA
SCHEMBL4342241 0.82 CSNK1E (0.34) CSNK1ECSNK1DKDM4EDCAF1HCRTR1
SCHEMBL4348191 0.81 KDM4E (0.35) KDM4EALDH1A1HTT
SCHEMBL4332589 0.81 ACLY (0.33)
SCHEMBL6426342 0.80 ENPP2 (0.31)
SCHEMBL4343214 0.75 CSNK1E (0.35) CSNK1ECSNK1DKDM4EALDH1A1LMNA
SCHEMBL4339201 0.67 JAK2 (0.38) CSNK1ECSNK1DKDM4EEGFRHCRTR1
SCHEMBL4333973 0.67 PLAU (0.33)
SCHEMBL4340947 0.66 PTGER1 (0.36) CSNK1ECSNK1DDCLRE1BICMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CSNK1E 202/4885CSNK1D 134/4885KDM4E 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.