SCHEMBL5136090

SCHEMBL5136090

O=C(c1cccc2c1-c1ccccc1C2)N(Cc1ccccc1)C1Cc2ccccc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
HTR2B P41595 1/20 0.43
AGER Q15109 3/20 0.39
MTNR1A P48039 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM3 P20309 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
C5AR1 P21730 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
GCGR P47871 1/20 0.36
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL5135641 0.89 HCRTR1 (0.39) POLBHTR2BALDH1A1MEN1KMT2A
SCHEMBL5134846 0.84 POLB (0.40) POLBHTR2BALDH1A1MEN1KMT2A
SCHEMBL5138056 0.84 MAPT (0.46) POLBHTR2BALDH1A1C5AR1KDM4E
SCHEMBL5136851 0.83 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ATSHR
SCHEMBL5137387 0.83 MEN1 (0.57) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL5134499 0.79 HTR1A (0.40) AGERMTNR1ACHRM2CHRM3ALDH1A1
SCHEMBL5134903 0.78 MTTP (0.50) ALDH1A1MEN1KMT2AHCRTR1HCRTR2
SCHEMBL5359589 0.78 MEN1 (0.51) ALDH1A1MEN1KMT2ALTB4R2DRD3
SCHEMBL5135704 0.77 KMT2A (0.45) ALDH1A1MEN1KMT2ALTB4R2DRD3
SCHEMBL5136654 0.76 MEN1 (0.49) ALDH1A1MEN1KMT2ALTB4R2DRD3

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
EP-1490044-A4 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORP (US) 2008-04-16 EP claimed
EP-1490044-A1 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORPORATION (US) 2004-12-29 EP claimed
US-20040014782-A1 Combination therapy for the treatment of diseases involving inflammatory components NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2004-01-22 US claimed
WO-2003084524-A1 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORPORATION (US) 2003-10-16 WO claimed
EP-1490044-A4 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORP (US) 2008-04-16 EP disclosed
EP-1490044-A1 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORPORATION (US) 2004-12-29 EP disclosed
WO-2003084524-A1 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORPORATION (US) 2003-10-16 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-20040014782-A1 Combination therapy for the treatment of diseases involving inflammatory components C5AR1, C5AR2, C3AR1 POLB 2902/4885HTR2B 656/4885AGER 253/4885

“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.