SCHEMBL4483162

SCHEMBL4483162

CCOC(=O)c1[nH]nc2c1C[C@@H]1C(COC)[C@H]21

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 11/20 0.50
MAPK10 P53779 2/20 0.40
AURKA O14965 1/20 0.40
RIPK1 Q13546 1/20 0.40
HSD17B10 Q99714 1/20 0.36
PDE4D Q08499 1/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
RECQL P46063 1/20 0.35
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL4486026 1.00 HCAR2 (0.50) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL4477061 0.89 HCAR2 (0.47) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL13631571 0.89 HCAR2 (0.47) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL4491886 0.89 HCAR2 (0.47) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL4478915 0.88 HCAR2 (0.41) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL13673226 0.88 HCAR2 (0.41) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL4500079 0.88 HCAR2 (0.41) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL13631585 0.86 HCAR2 (0.49) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL4486200 0.86 HCAR2 (0.49) HCAR2MAPK10AURKARIPK1HSD17B10
SCHEMBL4476883 0.85 HCAR2 (0.61) HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612106-B2 Fused pyrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2009-11-03 US disclosed
US-20090258892-A1 FUSED PYRAZOLE DERIVATIVES AND METHODS OF TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2009-10-15 US disclosed
US-20070073062-A1 Fused pyrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. 2007-03-29 US disclosed
US-20060205955-A1 Fused pyrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2006-09-14 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 (3 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-20090258892-A1 FUSED PYRAZOLE DERIVATIVES AND METHODS OF TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ACE, ACE2, AGTR2 HCAR2 300/4885MAPK10 4448/4885AURKA 3931/4885
US-20070073062-A1 Fused pyrazole derivatives and methods of treatment of metabolic-related disorders thereof ACE, ACE2, AGTR2 HCAR2 300/4885MAPK10 4448/4885AURKA 3931/4885
US-20060205955-A1 Fused pyrazole derivatives and methods of treatment of metabolic-related disorders thereof ACE, ACE2, AGTR2 HCAR2 300/4885MAPK10 4448/4885AURKA 3931/4885

“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.