SCHEMBL15780665

SCHEMBL15780665

CN(CCOP(=O)(O)O)CC1CCC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MVD P53602 1/20 0.40
LPAR3 Q9UBY5 4/20 0.34
LPAR1 Q92633 2/20 0.34
LPAR2 Q9HBW0 2/20 0.34
ALOX5 P09917 2/20 0.33
GGPS1 O95749 2/20 0.33
LSS P48449 1/20 0.33
CDC25A P30304 2/20 0.31
CDC25B P30305 2/20 0.31

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
SCHEMBL14401027 0.93 MVD (0.41) MVDLPAR3LPAR1LPAR2GGPS1
SCHEMBL14048822 0.77 LPAR3 (0.37) MVDLPAR3LPAR1LPAR2
SCHEMBL15780668 0.76 FDPS (0.39) MVDLPAR3LPAR1LPAR2
SCHEMBL3429140 0.75 OPRM1 (0.33) LPAR3LPAR1LPAR2ALOX5
SCHEMBL3429142 0.75 OPRM1 (0.33) LPAR3LPAR1LPAR2ALOX5
SCHEMBL14048919 0.75 FDPS (0.42) MVDLPAR3LPAR1LPAR2
SCHEMBL23918621 0.73 PIK3CD (0.41) ALOX5LSS
SCHEMBL3489299 0.72 MVD (0.47) MVDLPAR3LPAR1LPAR2GGPS1
SCHEMBL13531689 0.72 MVD (0.47) MVDLPAR3LPAR1LPAR2GGPS1
SCHEMBL14048820 0.72 LPAR3 (0.38) MVDLPAR3LPAR1LPAR2GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9567358-B2 Methods of treatment using N-(3-fluorophenyl)-2-{3-[(7-{3-[ethyl(2-hydroxyethyl)amino]propoxy}-quinazolin-4-yl)amino]-1H-pyrazol-5-yl}acetamide ASTRAZENECA AB (SE) 2017-02-14 US disclosed
US-9018191-B2 Phosphonoxy quinazoline derivatives and their pharmaceutical use ASTRAZENECA AB (SE) 2015-04-28 US disclosed
US-20140162984-A1 PHOSPHONOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2014-06-12 US disclosed
US-20140162984-A1 PHOSPHONOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2014-06-12 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-20140162984-A1 PHOSPHONOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE PLK2, ABL1, CYP3A5 MVD 1497/4885LPAR3 3136/4885LPAR1 3601/4885

“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.