SCHEMBL15038296

SCHEMBL15038296

O=P(O)(O)C(O)(c1cnccn1)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.43
FDPS P14324 10/20 0.39
BTN3A1 O00481 1/20 0.39
PDE3A Q14432 1/20 0.39
KDM4E B2RXH2 2/20 0.38
NAPRT Q6XQN6 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
TSHR P16473 1/20 0.35
MC4R P32245 1/20 0.35
ADRA1A P35348 1/20 0.35
MC3R P41968 1/20 0.35
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL15038325 0.81 KDM4E (0.42) CYP19A1FDPSBTN3A1PDE3AKDM4E
SCHEMBL10704341 0.72 L3MBTL1 (0.57) FDPSNAPRT
SCHEMBL16231362 0.70 CYP19A1 (0.48) CYP19A1KDM4ENAPRTHCAR2BAZ2B
SCHEMBL9474833 0.70 CYP19A1 (0.48) CYP19A1KDM4ENAPRTHCAR2BAZ2B
SCHEMBL3293497 0.69 CYP19A1 (0.47) CYP19A1KDM4ENAPRTHCAR2BAZ2B
SCHEMBL13746036 0.67 FDPS (0.53) CYP19A1FDPSBTN3A1PDE3A
SCHEMBL5720338 0.66 CYP19A1 (0.44) CYP19A1KDM4ENAPRTHCAR2BAZ2B
SCHEMBL8337291 0.66 KDM4E (0.41) FDPSKDM4ENAPRTHCAR2BAZ2B
SCHEMBL31256061 0.64 CYP19A1 (0.42) CYP19A1KDM4ENAPRTHCAR2BAZ2B
SCHEMBL179284 0.64 CYP19A1 (0.42) CYP19A1KDM4ENAPRTHCAR2BAZ2B

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-20140339098-A1 PROCESS AND CATALYST FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE SOLVAY SA (BE) 2014-11-20 US disclosed
US-20140339098-A1 PROCESS AND CATALYST FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE SOLVAY SA (BE) 2014-11-20 US disclosed
WO-2013087792-A2 PROCESS AND CATALYST FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE SOLVAY SA (BE) 2013-06-20 WO 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-20140339098-A1 PROCESS AND CATALYST FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE BPGM, CA4, CA6 CYP19A1 763/4885FDPS 259/4885BTN3A1 1216/4885

“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.