SCHEMBL18873441

SCHEMBL18873441

CC(C)(N)CC(C)(N)C(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.44
GRM4 Q14833 1/20 0.41
LMNA P02545 2/20 0.40
PDE3A Q14432 2/20 0.33
ADRB3 P13945 1/20 0.33
PDE4D Q08499 1/20 0.33
SMPD1 P17405 2/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
GGPS1 O95749 2/20 0.30

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
SCHEMBL132711 0.82 FDPS (0.44) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL12076054 0.81 FDPS (0.48) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL7954088 0.76 FDPS (0.48) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL24026519 0.73 FDPS (0.50) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL4097085 0.72 FDPS (0.55) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL3846262 0.68
SCHEMBL16639272 0.67 LMNA (0.43) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL2384958 0.66 LMNA (0.56) FDPSGRM4LMNAPDE3AADRB3
SCHEMBL10640273 0.65
SCHEMBL5355267 0.65

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-20220242893-A1 AMIDE-LINKED CONJUGATE COMPOUNDS AND USES THEREOF UNIV FRASER SIMON (CA) 2022-08-04 US disclosed
US-9650414-B1 Dual-action EP4 agonist—bisphosphonate conjugates and uses thereof SIMON FRASER UNIVERSITY (CA) 2017-05-16 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-20220242893-A1 AMIDE-LINKED CONJUGATE COMPOUNDS AND USES THEREOF AADAC, DNPEP, NAALAD2 FDPS 769/4885GRM4 2329/4885LMNA 3003/4885

“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.