SCHEMBL2568258

SCHEMBL2568258

COC(=O)C(Cc1ccc(N(C)C)cc1)C(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
HPGD P15428 5/20 0.49
KDM4E B2RXH2 3/20 0.49
NPC1 O15118 2/20 0.49
TSHR P16473 2/20 0.49
MAPK1 P28482 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ACACB O00763 1/20 0.48
PTPRB P23467 1/20 0.48
KMT2A Q03164 1/20 0.45
PPARG P37231 3/20 0.43
PPARD Q03181 3/20 0.43
PPARA Q07869 3/20 0.43
LDHA P00338 1/20 0.42
MAPT P10636 5/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
ESR1 P03372 1/20 0.42

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
SCHEMBL2567777 0.83 ALDH1A1 (0.49) ALDH1A1HPGDKDM4ENPC1TSHR
SCHEMBL4849611 0.82 PTPRB (0.51) ALDH1A1ACACBPTPRBPPARGPPARD
SCHEMBL6506164 0.82 ESR1 (0.61) NPC1TSHRPTPRBKMT2APPARG
SCHEMBL2569999 0.81 PTPRB (0.50) NPC1PTPRBPPARGPPARDPPARA
SCHEMBL3800254 0.81 LDHA (0.67) SMN1; SMN2ACACBPTPRBPPARGPPARD
SCHEMBL855971 0.81 NOS2 (0.50) TSHRGAAPTPRBKMT2APPARG
SCHEMBL1259770 0.80 MMP8 (0.54) ALDH1A1NPC1HSD17B10PTPRBKMT2A
SCHEMBL6310915 0.79 LOXL2 (0.53) ALDH1A1HPGDKDM4ENPC1TSHR
SCHEMBL6384936 0.79 PPARG (0.57) ALDH1A1KDM4ETSHRHSD17B10ACACB
SCHEMBL10595550 0.78 LDHA (0.56) ALDH1A1HPGDNPC1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102333769-B Derivatives of 2-pyridin-2-yl-pyrazol-3 (2H) -one, preparation thereof, and therapeutic use as HIF activators SANOFI AVENTIS 2014-08-27 CN disclosed
EP-2382205-B1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI SA (FR) 2014-04-23 EP disclosed
US-8541455-B2 Derivatives of 2-pyridin-2-yl-pyrazol-3(2H)-one, preparation and therapeutic use thereof as HIF activators SANOFI (FR) 2013-09-24 US disclosed
CN-102333769-A Derivatives of 2-pyridin-2-yl-pyrazol-3 (2H) -one, preparation thereof, and therapeutic use as HIF activators SANOFI AVENTIS 2012-01-25 CN disclosed
US-20110294788-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI (FR) 2011-12-01 US disclosed
EP-2382205-A2 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI (FR) 2011-11-02 EP disclosed
WO-2010076524-A2 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI-AVENTIS (FR) 2010-07-08 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-20110294788-A1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS HIF1AN, HIF1A, EGLN2 ALDH1A1 1475/4885HPGD 191/4885KDM4E 1006/4885

“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.