SCHEMBL4091111

SCHEMBL4091111

CCOC(=O)CN1CCCC[C@@H]1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.49
CHRM2 P08172 1/20 0.46
ALDH1A1 P00352 8/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TSHR P16473 2/20 0.43
ALOX15 P16050 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
SCN1A P35498 1/20 0.43
SCN2A Q99250 1/20 0.43
SCN3A Q9NY46 1/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 3/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
TERT O14746 1/20 0.41
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41

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
SCHEMBL4085362 1.00 HRH3 (0.49) HRH3CHRM2ALDH1A1L3MBTL1TSHR
SCHEMBL4093576 0.95 HRH3 (0.53) HRH3CHRM2ALDH1A1L3MBTL1TSHR
SCHEMBL19718782 0.84 HRH3 (0.60) HRH3ALDH1A1SCN1ASCN2ASCN3A
SCHEMBL23317870 0.83 CHRM2 (0.48) HRH3CHRM2ALDH1A1L3MBTL1TSHR
SCHEMBL2088330 0.81 HRH3 (0.57) HRH3TSHRSCN1ASCN2ASCN3A
SCHEMBL489181 0.79 HRH3 (0.64) HRH3ALDH1A1SCN1ASCN2ASCN3A
SCHEMBL489180 0.79 HRH3 (0.64) HRH3ALDH1A1SCN1ASCN2ASCN3A
SCHEMBL19718789 0.78 HDAC8 (0.41) HRH3ALDH1A1L3MBTL1ALOX15CRHBP
SCHEMBL13868417 0.78 MGAM (0.44) ALDH1A1KDM4EKMT2AHSD17B10GAA
SCHEMBL4085410 0.77 ALDH1A1 (0.43) HRH3ALDH1A1L3MBTL1KDM4EHPGD

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 2504/4885CHRM2 1793/4885ALDH1A1 3165/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 HRH3 2769/4885CHRM2 2022/4885ALDH1A1 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.