SCHEMBL7609133

SCHEMBL7609133

CC(=O)Oc1ccc2nc(-c3cccnc3)nc(NCCOCCO)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.53
LATS1 O95835 1/20 0.53
GBA1 P04062 8/20 0.53
CYP1A2 P05177 3/20 0.53
CYP3A4 P08684 3/20 0.53
TSHR P16473 3/20 0.53
CLK4 Q9HAZ1 3/20 0.53
KDM4E B2RXH2 2/20 0.49
GAA P10253 1/20 0.49
PKM P14618 1/20 0.49
USP2 O75604 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
RECQL P46063 1/20 0.48

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
SCHEMBL7604753 0.89 LMNA (0.57) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7632937 0.89 LATS1 (0.62) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7609072 0.86 ALDH1A1 (0.58) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7609160 0.86 CYP1A2 (0.55) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7611890 0.85 ALDH1A1 (0.55) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7613450 0.85 PDE5A (0.65) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7611406 0.84 GBA1 (0.62) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7610140 0.84 ALDH1A1 (0.60) LMNAALDH1A1HPGDLATS1GBA1
SCHEMBL7433275 0.83 PDE5A (0.68) LMNAALDH1A1GBA1CYP1A2CYP3A4
SCHEMBL7613487 0.83 PDE5A (0.65) LMNAALDH1A1HPGDLATS1GBA1

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 LMNA 902/4885ALDH1A1 1566/4885HPGD 641/4885

“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.