SCHEMBL22235083

SCHEMBL22235083

O=P(OCc1cccnc1)(OCc1cccnc1)OP(=O)(OCc1cccnc1)OCc1cccnc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.47
BTN3A1 O00481 1/20 0.46
PDE3A Q14432 1/20 0.46
NAPRT Q6XQN6 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
HDAC1 Q13547 1/20 0.44
CHRNA7 P36544 1/20 0.43
CHRNB2 P17787 3/20 0.42
CHRNA4 P43681 3/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
HTR1A P08908 1/20 0.42
DRD2 P14416 1/20 0.42
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41

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
SCHEMBL207655 0.93 FDPS (0.50) FDPSBTN3A1PDE3ANAPRTCYP1A2
SCHEMBL28384938 0.86 GAA (0.46) FDPSBTN3A1PDE3ANAPRTCYP1A2
SCHEMBL28386449 0.85 LMNA (0.46) FDPSBTN3A1PDE3ACHRNB2CHRNA4
SCHEMBL207656 0.82 FDPS (0.56) FDPSBTN3A1PDE3ANAPRTCYP1A2
SCHEMBL30102567 0.82 FDPS (0.56) FDPSBTN3A1PDE3ANAPRTCYP1A2
SCHEMBL8394763 0.81 FDPS (0.54) FDPSBTN3A1PDE3ANAPRTCYP1A2
SCHEMBL22235085 0.80 FDPS (0.50) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL17034259 0.79 FDPS (0.53) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL19353234 0.78 LMNA (0.46) FDPSBTN3A1PDE3ACHRNB2CHRNA4
SCHEMBL17034258 0.78 LMNA (0.46) FDPSBTN3A1PDE3ACHRNB2CHRNA4

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-20220162188-A1 ISOPRENOIDS AND METHODS OF MAKING THEREOF NORTH CAROLINA STATE UNIVERSITY 2022-05-26 US disclosed
EP-3911740-A1 ISOPRENOIDS AND METHODS OF MAKING THEREOF North Carolina State University (US) 2021-11-24 EP disclosed
WO-2020150340-A1 ISOPRENOIDS AND METHODS OF MAKING THEREOF NORTH CAROLINA STATE UNIVERSITY (US) 2020-07-23 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-20220162188-A1 ISOPRENOIDS AND METHODS OF MAKING THEREOF GGPS1, SQLE, FDPS FDPS 3/4885BTN3A1 4223/4885PDE3A 818/4885

“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.