SCHEMBL7525906

SCHEMBL7525906

CCNc1cc2ncnc(NCc3cccc(N4CCCCC4)c3)c2cc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.52
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
CYP3A4 P08684 1/20 0.48
PDGFRB P09619 1/20 0.45
MET P08581 1/20 0.45
EGFR P00533 4/20 0.44
MAP4K4 O95819 1/20 0.44
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SIRT6 Q8N6T7 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL7531321 0.92 MAPK1 (0.54) MAPTNPSR1PDGFRBMETEGFR
SCHEMBL7525212 0.92 MAPT (0.52) MAPTNPSR1PDGFRBMETEGFR
SCHEMBL7518944 0.90 MAPT (0.54) MAPTCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL7522631 0.89 MAPT (0.55) MAPTCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL7526582 0.89 PDGFRB (0.46) MAPTPDGFRBMETEGFRMAPK1
SCHEMBL8796055 0.84 RPS6KB1 (0.47) PDGFRBEGFRMAPK1ALDH1A1HTT
SCHEMBL7527697 0.83 EGFR (0.48) MAPTCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL7530560 0.83 EGFR (0.48) MAPTCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL7526254 0.83 EGFR (0.48) MAPTCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8825839 0.83 EGFR (0.62) EGFRMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020193389-A1 Method of inhibiting neoplastic cells with imidazoquinazoline derivatives OSI PHARMACEUTICALS, INC. 2002-12-19 US disclosed
US-6127541-A 8-((DISUBSTITUTED AMINO)BENZYLAMINO)-2,3-DIHYDRO-1H-IMIDAZO(4,5-G)QUINAZOLINE-(2-THIONE OR 2-ONE); SELECTIVE CYCLIC GUANOSINE 3',5' MONOPHOSPHATE (CGMP)--SPECIFIC PHOSPHODIESTERASE (PDE) INHIBITORY ACTIVITY KYOWA HAKKO KOGYO CO., LTD. (JP) 2000-10-03 US disclosed
EP-0863144-A1 IMIDAZOQUINAZOLINE DERIVATIVES Kyowa Hakko Co., Ltd. (JP) 1998-09-09 EP 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-20020193389-A1 Method of inhibiting neoplastic cells with imidazoquinazoline derivatives MKI67, HRAS, VHL MAPT 4593/4885CYP1A2 2521/4885CYP2C9 3664/4885

“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.