SCHEMBL7609138

SCHEMBL7609138

COC(=O)c1ccc2nc(Cn3ccnc3)nc(NCCOCCO)c2c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.38
TBXAS1 P24557 10/20 0.38
CYP19A1 P11511 1/20 0.37
CTNNB1 P35222 1/20 0.37
TCF7L2 Q9NQB0 1/20 0.37
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
NUDT1 P36639 1/20 0.36
NAMPT P43490 2/20 0.36

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
SCHEMBL7610224 0.91 GAA (0.41) LATS1KDM4EGAATBXAS1NAMPT
SCHEMBL7612790 0.86 NUDT1 (0.49) LATS1GAATBXAS1CYP19A1NUDT1
SCHEMBL7289797 0.85 PDE5A (0.50) LATS1TBXAS1HTT
SCHEMBL7605584 0.84 PDE5A (0.44) LATS1KDM4ETBXAS1CYP19A1NPC1
SCHEMBL7605721 0.82 ALDH1A1 (0.50) LATS1KDM4EGAATBXAS1CYP19A1
SCHEMBL7607820 0.82 PDE5A (0.46) LATS1KDM4EGAACYP19A1NPC1
SCHEMBL7611430 0.79 LATS1 (0.64) LATS1KDM4EGAAPOLB
SCHEMBL7607885 0.79 EGFR (0.49) LATS1KDM4EGAACYP19A1HTT
SCHEMBL7607045 0.78 EGFR (0.48) LATS1KDM4EGAATBXAS1CYP19A1
SCHEMBL7610497 0.78 NUDT1 (0.48) KDM4ETBXAS1CYP19A1NPC1NUDT1

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
US-20020025968-A1 Method for inhibiting neoplastic cells and related conditions by exposure to 4-aminoquinazoline derivatives OSI PHARMACEUTICALS, INC. 2002-02-28 US disclosed
US-5439895-A Cardiovascular disorders; inhibitor of thromboxane A2 synthetase and cyclic guanosine 3',5'-monophosphate ONO PHARMACEUTICAL CO., LTD. (JP) 1995-08-08 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-20020025968-A1 Method for inhibiting neoplastic cells and related conditions by exposure to 4-aminoquinazoline derivatives VHL, MCL1, NFATC1 LATS1 674/4885KDM4E 1236/4885GAA 2476/4885

“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.