SCHEMBL6017253

SCHEMBL6017253

Cc1ccc(C2CN(C(=O)OC(C)(C)C)CCN2)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.49
KMT2A Q03164 2/20 0.46
MAPK1 P28482 1/20 0.43
MMP13 P45452 1/20 0.41
TP53 P04637 3/20 0.41
PDE4B Q07343 1/20 0.41
RORC P51449 1/20 0.40
MEN1 O00255 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL26102356 1.00 GPR119 (0.49) GPR119KMT2AMAPK1MMP13TP53
SCHEMBL16026535 0.90 ESR2 (0.44) GPR119KMT2AMAPK1PDE4BRORC
SCHEMBL17519223 0.89 RORC (0.44) GPR119KMT2AMAPK1MMP13PDE4B
SCHEMBL3694375 0.89 RORC (0.44) GPR119KMT2AMAPK1MMP13PDE4B
SCHEMBL28844910 0.89 RORC (0.49) GPR119MAPK1PDE4BRORC
SCHEMBL3694373 0.89 RORC (0.44) GPR119KMT2AMAPK1MMP13PDE4B
SCHEMBL3318358 0.89 MEN1 (0.49) KMT2AMAPK1TP53PDE4BMEN1
SCHEMBL19745334 0.88 MAPK1 (0.50) GPR119MAPK1RORC
SCHEMBL5651780 0.88 MAPK1 (0.50) GPR119MAPK1RORC
SCHEMBL28225677 0.88 MAPK1 (0.50) GPR119MAPK1RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4423090-A2 ANTAGONISTS OF GPR39 PROTEIN Vasocardea, Inc. (US) 2024-09-04 EP disclosed
WO-2023076219-A2 ANTAGONISTS OF GPR39 PROTEIN VASOCARDEA, INC. (US) 2023-05-04 WO disclosed
WO-2023076219-A2 ANTAGONISTS OF GPR39 PROTEIN VASOCARDEA, INC. (US) 2023-05-04 WO disclosed
US-20130005710-A1 AMINOPYRIDINE DERIVATIVE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-01-03 US disclosed
US-20060264420-A1 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2006-11-23 US disclosed
EP-1539180-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2006-08-30 EP disclosed
EP-1682534-A2 PYRIMIDIN-4-ONE COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2006-07-26 EP disclosed
EP-1663219-A2 USE OF INDOLE-DERIVED COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT THAT CAN BE USED TO TREAT DISEASES RELATED TO THE SPLICING PROCESS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2006-06-07 EP disclosed
US-20050197327-A1 Compounds, compositions, and methods CYTOKINETICS, INCORPORATED 2005-09-08 US disclosed
EP-1539180-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-06-15 EP disclosed
WO-2005041888-A2 PYRIMIDIN-4-ONE COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-05-12 WO disclosed
WO-2005023255-A2 USE OF INDOLE-DERIVED COMPOUNDS FOR THE PREPARATION OF A MEDICAMENT THAT CAN BE USED TO TREAT DISEASES RELATED TO THE SPLICING PROCESS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2005-03-17 WO disclosed
US-20040048853-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2004-03-11 US disclosed
WO-2004018058-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2004-03-04 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 (4 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-20060264420-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 GPR119 2716/4885KMT2A 1458/4885MAPK1 2739/4885
US-20130005710-A1 AMINOPYRIDINE DERIVATIVE DCX, NR0B1, NR4A1 GPR119 1116/4885KMT2A 171/4885MAPK1 750/4885
US-20050197327-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 GPR119 2991/4885KMT2A 2023/4885MAPK1 3091/4885
US-20040048853-A1 Compounds, compositions, and methods ALPP, PCNA, MKI67 GPR119 2716/4885KMT2A 1458/4885MAPK1 2739/4885

“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.