SCHEMBL14769243

SCHEMBL14769243

CC(C)C(=O)OCOP(=O)(Cc1ccncc1)OCOC(=O)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.41
NAMPT P43490 2/20 0.35
LMNA P02545 3/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
FDPS P14324 1/20 0.34
HPGD P15428 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PTGS2 P35354 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
POLB P06746 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
SCHEMBL14769251 0.83 FDPS (0.43) LMNAFDPSHPGDKDM4EKMT2A
SCHEMBL3658477 0.74 NPY5R (0.42) LMNAMAPTFDPSTSHRKDM4E
SCHEMBL6732496 0.74 CYP19A1 (0.50) CYP19A1NAMPTLMNAMAPTMAPK1
SCHEMBL14769163 0.69 LIPG (0.38) MAPT
SCHEMBL12723088 0.68 CYP19A1 (0.39) CYP19A1NAMPTLMNAMAPTMAPK1
SCHEMBL14771736 0.67 PPARD (0.36) MAPTALDH1A1POLB
SCHEMBL14769167 0.66 BTN3A1 (0.35)
SCHEMBL13347323 0.66 PGK1 (0.39)
SCHEMBL28635378 0.66 PGK1 (0.30) MAPTALDH1A1POLB
SCHEMBL13347321 0.66 TP53 (0.42) MAPTALDH1A1POLB

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-20130065857-A1 NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY BAYLOR COLLEGE OF MEDICINE (US) 2013-03-14 US disclosed
US-20130065857-A1 NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY BAYLOR COLLEGE OF MEDICINE (US) 2013-03-14 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-20130065857-A1 NOVEL DXR INHIBITORS FOR ANTIMICROBIAL THERAPY DDX18, FPR1, DCXR CYP19A1 4290/4885NAMPT 689/4885LMNA 4225/4885

“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.