SCHEMBL2787635

SCHEMBL2787635

COc1ccccc1C(C(=O)Nc1ccccc1)N(CCc1c[nH]c2ccccc12)C(=O)CCNC(=N)N

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.47
KMT2A Q03164 13/20 0.45
MEN1 O00255 12/20 0.45
CDK4 P11802 2/20 0.44
CCND1 P24385 2/20 0.44
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.42
ALOX12 P18054 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ACHE P22303 1/20 0.40

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
SCHEMBL2788564 0.91 MEN1 (0.46) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2787930 0.91 MEN1 (0.45) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2788511 0.90 CDK4 (0.48) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2790691 0.89 MEN1 (0.45) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2787736 0.89 MEN1 (0.45) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2788223 0.88 MEN1 (0.46) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2788832 0.85 MEN1 (0.41) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2788365 0.85 GOT1 (0.49) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2787992 0.85 GOT1 (0.49) MAPTKMT2AMEN1CDK4CCND1
SCHEMBL2787706 0.85 GOT1 (0.44) MAPTKMT2AMEN1CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099815-B1 NOVEL AMIDES ACTING ON THE ADENOSINE RECEPTORS ANAMAR AB (SE) 2012-06-20 EP claimed
US-8227502-B2 Amides acting on the adenosine receptors ANAMAR AB (SE) 2012-07-24 US disclosed
EP-2099815-B1 NOVEL AMIDES ACTING ON THE ADENOSINE RECEPTORS ANAMAR AB (SE) 2012-06-20 EP disclosed
US-20100098629-A1 Novel Amides Acting on the Adenosine Receptors ACURE PHARMA AB (SE) 2010-04-22 US disclosed
EP-2099815-A2 NOVEL AMIDES ACTING ON THE ADENOSINE RECEPTORS Acure Pharma AB (SE) 2009-09-16 EP disclosed
WO-2008058679-A2 NOVEL AMIDES ACTING ON THE ADENOSINE RECEPTORS ACURE PHARMA AB (SE) 2008-05-22 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-20100098629-A1 Novel Amides Acting on the Adenosine Receptors ADORA1, ADORA3, ADORA2B MAPT 4617/4885KMT2A 3804/4885MEN1 4664/4885

“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.