SCHEMBL4083941

SCHEMBL4083941

COCCN(CCOC)CC(=O)NN

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSD P07339 2/20 0.35
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
CA2 P00918 2/20 0.32
CA1 P00915 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP2D6 P10635 1/20 0.32
KDM5C P41229 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
GAA P10253 2/20 0.31
HCRTR2 O43614 1/20 0.30
KCNQ3 O43525 1/20 0.30
KCNQ2 O43526 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
SCHEMBL4039558 0.78 TSHR (0.36) ALDH1A1LMNATSHRBLMPMP22
SCHEMBL11384926 0.77 CTSD (0.50) CTSDKDM4EALDH1A1LMNAMAPT
SCHEMBL7816889 0.77 BLM (0.35) KDM4EALDH1A1LMNATSHRCA2
SCHEMBL3571283 0.77 TSHR (0.40) KDM4EALDH1A1LMNATSHRBLM
SCHEMBL219297 0.75 TDP1 (0.46) CTSDKDM4EALDH1A1LMNAMAPT
SCHEMBL220412 0.75 KDM4E (0.43) CTSDKDM4EALDH1A1LMNAMAPT
SCHEMBL6347011 0.74 BLM (0.58) KDM4EALDH1A1LMNATSHRCA2
SCHEMBL12735158 0.74 TRPA1 (0.39) KDM4EALDH1A1LMNATSHRBLM
SCHEMBL7816887 0.72 BLM (0.40) KDM4EALDH1A1LMNAMAPTTSHR
SCHEMBL15177374 0.72 BLM (0.40) KDM4EALDH1A1LMNATSHRCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 WO 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 CTSD 4644/4885KDM4E 3468/4885ALDH1A1 3165/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 CTSD 4643/4885KDM4E 3359/4885ALDH1A1 3055/4885

“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.