SCHEMBL1491068

SCHEMBL1491068

Nc1ccnn1Cc1ccccc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
PKM P14618 2/20 0.51
MAPT P10636 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ADORA2A P29274 8/20 0.45
ADORA1 P30542 8/20 0.45
CYP2A13 Q16696 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
ADORA2B P29275 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GRM2 Q14416 1/20 0.42
POLB P06746 1/20 0.42
GUCY1B2 O75343 1/20 0.42
GUCY1A2 P33402 1/20 0.42
OPRK1 P41145 1/20 0.42
GUCY1A1 Q02108 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
SCHEMBL15733013 0.82 ALDH1A1 (0.46) ALDH1A1PKMMAPTL3MBTL1KDM4E
SCHEMBL1491101 0.81 MEN1 (0.58) ALDH1A1PKML3MBTL1KDM4EMEN1
SCHEMBL1491137 0.80 KDM4E (0.56) ALDH1A1PKMMAPTL3MBTL1KDM4E
SCHEMBL3605369 0.79 GRM2 (0.49) ALDH1A1PKMMAPTL3MBTL1KDM4E
SCHEMBL28325985 0.79 ALDH1A1 (0.44) ALDH1A1PKMMAPTL3MBTL1KDM4E
SCHEMBL1491114 0.79 KDM4E (0.50) ALDH1A1PKMKDM4EMEN1KMT2A
SCHEMBL1491106 0.79 KDM4E (0.46) ALDH1A1PKMKDM4EKMT2APOLB
SCHEMBL28866154 0.76 ALDH1A1 (0.41) ALDH1A1PKMMAPTL3MBTL1KDM4E
SCHEMBL1491059 0.76 NPBWR1 (0.48) ALDH1A1PKMMAPTL3MBTL1KDM4E
SCHEMBL10643199 0.75 ALDH1A1 (0.50) ALDH1A1PKMMAPTL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506193-B9 CARBAMATE-SUBSTITUTED PYRAZOLOPYRIDINES ADVERIO PHARMA GMBH (DE) 2026-02-18 EP disclosed
EP-1506193-B3 CARBAMATE-SUBSTITUTED PYRAZOLOPYRIDINES ADVERIO PHARMA GMBH (DE) 2025-12-03 EP disclosed
US-20110086889-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-04-14 US disclosed
EP-2288603-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2011-03-02 EP disclosed
WO-2009150614-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2009-12-17 WO disclosed
EP-0944631-B1 NOVEL SUBSTITUTED PYRAZOLE DERIVATIVES FOR THE TREATMENT OF CARDIOCIRCULATORY DISEASES BAYER HEALTHCARE AG (DE) 2004-02-18 EP disclosed
CN-1122032-C Novel substituted pyrazole derivatives for the treatment of cardiocirculatory diseases BAYER AG (DE) 2003-09-24 CN disclosed
US-6451805-B1 Substituted pyrazole derivatives for the treatment of cardiocirculatory diseases BAYER AKTIENGESELLSCHAFT (DE) 2002-09-17 US disclosed
CN-1238773-A Novel Substituted Pyrazole Derivatives for the Treatment of Cardiovascular Diseases BAYER AG (DE) 1999-12-15 CN disclosed
EP-0944631-A1 NOVEL SUBSTITUTED PYRAZOLE DERIVATIVES FOR THE TREATMENT OF CARDIOCIRCULATORY DISEASES BAYER AG (DE) 1999-09-29 EP disclosed
WO-1998023619-A1 NOVEL SUBSTITUTED PYRAZOLE DERIVATIVES FOR THE TREATMENT OF CARDIOCIRCULATORY DISEASES BAYER AKTIENGESELLSCHAFT (DE) 1998-06-04 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-20110086889-A1 TETRAZOLE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY1R ALDH1A1 3233/4885PKM 2177/4885MAPT 1288/4885

“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.