SCHEMBL4093576

SCHEMBL4093576

CCOC(=O)CN1CCCC1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.53
ALDH1A1 P00352 6/20 0.45
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP2D6 P10635 1/20 0.42
CHRM2 P08172 1/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.39
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
RAD52 P43351 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
GSK3A P49840 1/20 0.39

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
SCHEMBL4091111 0.95 HRH3 (0.49) HRH3ALDH1A1KDM4ESMN1; SMN2CHRM2
SCHEMBL4085362 0.95 HRH3 (0.49) HRH3ALDH1A1KDM4ESMN1; SMN2CHRM2
SCHEMBL489181 0.83 HRH3 (0.64) HRH3ALDH1A1KDM4ESMN1; SMN2CYP2D6
SCHEMBL489180 0.83 HRH3 (0.64) HRH3ALDH1A1KDM4ESMN1; SMN2CYP2D6
SCHEMBL2090636 0.81 HRH3 (0.62) HRH3ALDH1A1KDM4ESMN1; SMN2CYP2D6
SCHEMBL1855876 0.81 HRH3 (0.62) HRH3ALDH1A1KDM4ESMN1; SMN2CYP2D6
SCHEMBL2089690 0.81 HRH3 (0.62) HRH3ALDH1A1KDM4ESMN1; SMN2CYP2D6
SCHEMBL17614655 0.80 GABRA1 (0.42) HRH3ALDH1A1KMT2AABL1RIN1
SCHEMBL13868417 0.80 MGAM (0.44) ALDH1A1KDM4EKMT2AABL1RIN1
SCHEMBL23702630 0.79 GAA (0.44) HRH3ALDH1A1KDM4EKMT2AABL1

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 HRH3 2504/4885ALDH1A1 3165/4885KDM4E 3468/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 HRH3 2769/4885ALDH1A1 3055/4885KDM4E 3359/4885

“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.