SCHEMBL652912

SCHEMBL652912

CC(C)c1nn2ccccc2c1C(=O)[C@H](C)N

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.79
PDE5A O76074 6/20 0.79
PDE3A Q14432 4/20 0.79
MIF P14174 2/20 0.79
MEN1 O00255 1/20 0.79
ALDH1A1 P00352 1/20 0.79
CYP1A2 P05177 1/20 0.79
CYP3A4 P08684 1/20 0.79
CYP2D6 P10635 1/20 0.79
CYP2C9 P11712 1/20 0.79
TSHR P16473 1/20 0.79
PDE4A P27815 1/20 0.79
ADORA2A P29274 1/20 0.79
ADORA1 P30542 1/20 0.79
CYP2C19 P33261 1/20 0.79
BLM P54132 1/20 0.79
KMT2A Q03164 1/20 0.79
PDE4C Q08493 1/20 0.79
PDE4D Q08499 1/20 0.79
PDE3B Q13370 1/20 0.79

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
SCHEMBL10033623 1.00 PDE4B (0.79) PDE4BPDE5APDE3AMIFMEN1
SCHEMBL652753 1.00 PDE4B (0.79) PDE4BPDE5APDE3AMIFMEN1
Hydrochloric Acid SCHEMBL653339 0.99 PDE4B (0.77) PDE4BPDE5APDE3AMIFMEN1
Hydrochloric Acid SCHEMBL652575 0.99 PDE4B (0.77) PDE4BPDE5APDE3AMIFMEN1
Ibudilast SCHEMBL4194864 0.88 PDE4B (1.00) PDE4BPDE5APDE3AMIFMEN1
Ibudilast SCHEMBL30390 0.88 PDE4B (1.00) PDE4BPDE5APDE3AMIFMEN1
SCHEMBL8224246 0.87 PDE4B (0.77) PDE4BPDE5APDE3AMIFMEN1
SCHEMBL3203334 0.87 PDE4B (0.81) PDE4BPDE5APDE3AMIFMEN1
SCHEMBL3206069 0.87 PDE4B (0.71) PDE4BPDE5APDE3AMIFMEN1
SCHEMBL3192986 0.87 PDE4B (0.71) PDE4BPDE5APDE3AMIFMEN1

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445504-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS MediciNova, Inc. (US) 2012-05-02 EP claimed
US-8119657-B2 Enantiomeric compositions of 2-amino-1-(2-isopropylpyrazolo[1,5-α]pyridin-3-yl)propan-1-one and related methods MEDICINOVA, INC. (US) 2012-02-21 US claimed
WO-2010151551-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS MEDICINOVA, INC. (US) 2010-12-29 WO claimed
US-20100324082-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS MEDICINOVA, INC. 2010-12-23 US claimed
US-9295694-B2 Composition comprising silver nanoparticles and extracts of Polygonum Multiforum Thunb and the use thereof SKYLIGHT TECHNOLOGY LIMITED (CN) 2016-03-29 US disclosed
EP-2396010-B1 A COMPOSITION COMPRISING SILVER NANOPARTICLES AND EXTRACTS OF POLYGONUM MULTIFLORUM THUNB AND THE USE THEREOF TSAI MINGFEN (CN) 2013-08-14 EP disclosed
EP-2445504-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS MediciNova, Inc. (US) 2012-05-02 EP disclosed
EP-2445504-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS MediciNova, Inc. (US) 2012-05-02 EP disclosed
US-20120045480-A1 COMPOSITION COMPRISING SILVER NANOPARTICLES AND EXTRACTS OF POLYGONUM MULTIFLORUM THUNB AND THE USE THEREOF SKYLIGHT TECHNOLOGY LIMITED (CN) 2012-02-23 US disclosed
US-8119657-B2 Enantiomeric compositions of 2-amino-1-(2-isopropylpyrazolo[1,5-α]pyridin-3-yl)propan-1-one and related methods MEDICINOVA, INC. (US) 2012-02-21 US disclosed
US-8119657-B2 Enantiomeric compositions of 2-amino-1-(2-isopropylpyrazolo[1,5-α]pyridin-3-yl)propan-1-one and related methods MEDICINOVA, INC. (US) 2012-02-21 US disclosed
US-8119657-B2 Enantiomeric compositions of 2-amino-1-(2-isopropylpyrazolo[1,5-α]pyridin-3-yl)propan-1-one and related methods MEDICINOVA, INC. (US) 2012-02-21 US disclosed
US-20100324082-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS MEDICINOVA, INC. 2010-12-23 US disclosed
WO-2010091529-A1 A COMPOSITION COMPRISING SILVER NANOPARTICLES AND EXTRACTS OF POLYGONUM MULTIFLORUM THUNB AND THE USE THEREOF TSAI MINGFEN (CN) 2010-08-19 WO disclosed
US-20090011046-A1 Composition Comprising Silver Nanoparticles and the Use Thereof LIN CHENLUNG 2009-01-08 US disclosed
EP-1919488-A1 A COMPOSITION COMPRISING SILVER NANOPARTICLES AND THE USE THEREOF Lin, Chenlung (CN) 2008-05-14 EP disclosed
WO-2007014497-A1 A COMPOSITION COMPRISING SILVER NANOPARTICLES AND THE USE THEREOF LIN CHENLUNG (CN) 2007-02-08 WO disclosed
US-7125660-B2 Nucleic acid sensor molecules and methods of using same ARCHEMIX CORP. (US) 2006-10-24 US disclosed
EP-1354062-A2 TARGET ACTIVATED NUCLEIC ACID BIOSENSOR AND METHODS OF USING SAME Archemix Corporation (US) 2003-10-22 EP disclosed
WO-2002022882-A2 TARGET ACTIVATED NUCLEIC ACID BIOSENSOR AND METHODS OF USING SAME ARCHEMIX CORPORATION (US) 2002-03-21 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-20100324082-A1 ENANTIOMERIC COMPOSITIONS OF 2-AMINO-1-(2-ISOPROPYLPYRAZOLO[1,5-a]PYRIDIN-3-YL)PROPAN-1-ONE AND RELATED METHODS OPRK1, OPRL1, OPRD1 PDE4B 2121/4885PDE5A 2327/4885PDE3A 629/4885

“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.