SCHEMBL7605584

SCHEMBL7605584

OCCOCCNc1nc(Cn2ccnc2)nc2ccc(Cl)cc12

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.44
HTR3A P46098 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
LATS1 O95835 1/20 0.41
TBXAS1 P24557 2/20 0.40
QPCT Q16769 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PIK3CD O00329 1/20 0.39
PIK3R1 P27986 1/20 0.39
CYP19A1 P11511 3/20 0.38
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38
CYP2A6 P11509 1/20 0.38
CYP2B6 P20813 1/20 0.38
ADRA2C P18825 1/20 0.36
SNCA P37840 1/20 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
SCHEMBL7607210 0.90 PDE5A (0.43) PDE5AHTR3AHRH4LATS1QPCT
SCHEMBL7612790 0.87 NUDT1 (0.49) PDE5ALATS1TBXAS1QPCTCYP19A1
SCHEMBL7605721 0.86 ALDH1A1 (0.50) PDE5ALATS1TBXAS1QPCTKDM4E
SCHEMBL7607820 0.86 PDE5A (0.46) PDE5ALATS1KDM4ENPC1RAB9A
SCHEMBL7609138 0.84 LATS1 (0.40) LATS1TBXAS1KDM4ENPC1CYP19A1
SCHEMBL7280014 0.83 PDE5A (0.65) PDE5AHTR3AHRH4TBXAS1
Hydrochloric Acid SCHEMBL7279626 0.82 PDE5A (0.66) PDE5AHTR3AHRH4TBXAS1
SCHEMBL5595125 0.80 PDE5A (0.69) PDE5AHTR3AHRH4TBXAS1QPCT
Hydrochloric Acid SCHEMBL7278512 0.79 PDE5A (0.69) PDE5AHTR3AHRH4TBXAS1QPCT
SCHEMBL7610497 0.77 NUDT1 (0.48) PDE5ATBXAS1QPCTKDM4ENPC1

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 PDE5A 3794/4885HTR3A 932/4885HRH4 261/4885

“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.