SCHEMBL5569253

SCHEMBL5569253

Cc1cccc2c(Nc3ccc(C(=O)c4ccccc4)cc3)ncnc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 3/20 0.59
TTBK2 Q6IQ55 3/20 0.59
AURKA O14965 3/20 0.56
RPS6KB1 P23443 2/20 0.56
RAB9A P51151 3/20 0.49
MAPT P10636 3/20 0.49
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
USP2 O75604 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
DHODH Q02127 1/20 0.48
MAPK14 Q16539 2/20 0.48
MAPK13 O15264 1/20 0.48
MAPK12 P53778 1/20 0.48
MAPK11 Q15759 1/20 0.48
AURKB Q96GD4 4/20 0.46
EGFR P00533 3/20 0.46
POLB P06746 2/20 0.45

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
SCHEMBL5569470 0.85 EGFR (0.58) TTBK1TTBK2RAB9ANPC1SMN1; SMN2
SCHEMBL5568284 0.83 KDM4E (0.53) AURKARPS6KB1RAB9AMAPTNPC1
SCHEMBL5564469 0.82 ABCG2 (0.55) AURKARPS6KB1RAB9AMAPTNPC1
SCHEMBL5569158 0.80 ABCG2 (0.69) TTBK1TTBK2RAB9AMAPTNPC1
SCHEMBL5564499 0.80 KDR (0.65) TTBK1TTBK2RAB9AMAPTNPC1
Hydrochloric Acid SCHEMBL8809726 0.79 ABCG2 (0.68) TTBK1TTBK2RAB9AMAPTNPC1
SCHEMBL5569113 0.79 EGFR (0.53) TTBK1TTBK2AURKARPS6KB1RAB9A
SCHEMBL5568069 0.79 JAK2 (0.56) TTBK1TTBK2AURKARPS6KB1RAB9A
SCHEMBL5569346 0.79 CCNT1 (0.50) AURKARPS6KB1RAB9AMAPTNPC1
SCHEMBL5570053 0.79 HPGD (0.52) TTBK1TTBK2RAB9AMAPTNPC1

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
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US claimed
EP-1673346-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC Biotech AG (DE) 2006-06-28 EP claimed
WO-2005040125-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC BIOTECH AG (DE) 2005-05-06 WO claimed
US-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections GPC BIOTECH AG (DE) 2007-05-31 US disclosed
EP-1673346-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC Biotech AG (DE) 2006-06-28 EP disclosed
WO-2005040125-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT OF HERPESVIRAL INFECTIONS GPC BIOTECH AG (DE) 2005-05-06 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-20070123537-A1 Quinazoline derivatives for the treatment of herpesviral infections IRF3, PML, TPMT TTBK1 448/4885TTBK2 704/4885AURKA 151/4885

“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.