SCHEMBL3327264

SCHEMBL3327264

Cc1nc(-c2cc(Cl)ccc2Cl)c[nH]1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.47
ALDH1A1 P00352 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HTR2B P41595 1/20 0.42
PDE4D Q08499 1/20 0.42
AGPAT2 O15120 1/20 0.40
PTPN1 P18031 1/20 0.39
PKM P14618 1/20 0.39
CNR2 P34972 1/20 0.38
PDE2A O00408 4/20 0.38
PDE10A Q9Y233 3/20 0.38
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
ADORA3 P0DMS8 2/20 0.37
ADORA1 P30542 1/20 0.37
AR P10275 1/20 0.37
HTT P42858 1/20 0.35
HSD11B1 P28845 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
SCHEMBL7674674 0.86 HSP90AA1 (0.51) HSP90AA1HSP90AB1ARHSD11B1
SCHEMBL2568480 0.79 IDO1 (0.44) IDO1ALDH1A1RXFP1HTR2BPDE4D
SCHEMBL2868906 0.76 IDO1 (0.42) IDO1ALDH1A1RXFP1HTR2BPDE4D
SCHEMBL28812735 0.75 IDO1 (0.41) IDO1ALDH1A1RXFP1HTR2BPDE4D
SCHEMBL19627018 0.75 AHR (0.46) AR
SCHEMBL31305497 0.74 HPGD (0.44) IDO1ALDH1A1RXFP1HTR2BPDE4D
SCHEMBL3141265 0.74 HPGD (0.44) IDO1ALDH1A1RXFP1HTR2BPDE4D
SCHEMBL27967661 0.74 ADORA2A (0.41) IDO1ALDH1A1RXFP1HTR2BPDE4D
SCHEMBL13545715 0.74 PDGFRB (0.44) ALDH1A1PKM
SCHEMBL26110557 0.74 CXCR2 (0.45) IDO1ALDH1A1RXFP1HTR2BPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010054260-A1 IMIDAZO[5,1-C][1,2,4]BENZOTRIAZINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASES BIOTIE THERAPIES GMBH (DE) 2010-05-14 WO disclosed
US-20100120763-A1 IMIDAZO[5,1-C][1,2,4]BENZOTRIAZINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASES WYETH (US) 2010-05-13 US 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-20100120763-A1 IMIDAZO[5,1-C][1,2,4]BENZOTRIAZINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASES PDE2A, PDE5A, PDE3A IDO1 587/4885ALDH1A1 133/4885RXFP1 1827/4885

“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.