SCHEMBL3955646

SCHEMBL3955646

CCOC(=O)c1n[nH]c(C2CC2)c1F

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.60
KDM4E B2RXH2 4/20 0.43
POLB P06746 2/20 0.43
PDE4D Q08499 1/20 0.41
MTOR P42345 1/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 3/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ALOX15 P16050 1/20 0.38
LMNA P02545 1/20 0.35
MME P08473 1/20 0.35

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
SCHEMBL15056281 0.85 KDM4E (0.46) HCAR2KDM4EPOLBPDE4DMAPT
Hydrochloric Acid SCHEMBL15056842 0.84 KDM4E (0.44) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL24906430 0.82 KDM4E (0.43) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL28835673 0.82 KDM4E (0.43) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL30130665 0.79 KDM4E (0.41) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL24877924 0.78 KDM4E (0.43) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL679590 0.78 KDM4E (0.43) HCAR2KDM4EPOLBPDE4DMAPT
SCHEMBL3945902 0.78 HCAR2 (0.59) HCAR2KDM4EPOLBPDE4DMTOR
SCHEMBL28693887 0.78 KDM4E (0.50) HCAR2KDM4EPOLBPDE4DMTOR
SCHEMBL1412595 0.77 KDM4E (0.43) KDM4EPOLBPDE4DMAPTKMT2A

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
EP-1551403-B1 5-SUBSTITUTED 2H-PYRAZONE-3-CARBOXYLIC ACID DERIVATIVES AS ANTILIPOLYTIC AGENTS FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS SUCH AS DYSLIPIDEMIA ARENA PHARM INC (US) 2009-04-29 EP disclosed
US-20060167270-A1 5-substituted 2h-pyrazone-3-carbixylic acid derivatives as antilipolytic agents for the treatment of metabolic-related disorders such as dyslipidemia ARENA PHARMACEUTICALS INC. (US) 2006-07-27 US disclosed
EP-1551403-A1 5-SUBSTITUTED 2H-PYRAZONE-3-CARBOXYLIC ACID DERIVATIVES AS ANTILIPOLYTIC AGENTS FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS SUCH AS DYSLIPIDEMIA Arena Pharmaceuticals, Inc. (US) 2005-07-13 EP disclosed
WO-2004032928-A1 5-SUBSTITUTED 2H-PYRAZONE-3-CARBOXYLIC ACID DERIVATIVES AS ANTILIPOLYTIC AGENTS FOR THE TREATMENT OF METABOLIC-RELATED DISORDERS SUCH AS DYSLIPIDEMIA ARENA PHARMACEUTICALS, INC. (US) 2004-04-22 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 (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-20060167270-A1 5-substituted 2h-pyrazone-3-carbixylic acid derivatives as antilipolytic agents for the treatment of metabolic-related disorders such as dyslipidemia ACE, ACE2, AGTR2 HCAR2 30/4885KDM4E 2712/4885POLB 3903/4885

“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.