SCHEMBL23988425

SCHEMBL23988425

O=P(O)(O)CCNCC(O)COCCC[Si](O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LPAR5 Q9H1C0 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ANPEP P15144 2/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
PGK1 P00558 1/20 0.30
PGK2 P07205 1/20 0.30
TLR2 O60603 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
SCHEMBL23988533 0.87 LPAR5 (0.36) LPAR5KDM4E
SCHEMBL15218995 0.86 KDM4E (0.41) KDM4E
SCHEMBL19660807 0.85 KDM4E (0.40) KDM4E
SCHEMBL15218991 0.85 KDM4E (0.40) KDM4E
SCHEMBL15218975 0.83 KDM4E (0.39) LPAR5KDM4E
SCHEMBL29313966 0.82 LPAR5 (0.50) LPAR5KDM4EANPEPCYP3A4
SCHEMBL9927953 0.82 KDM4E (0.38) KDM4EANPEPCYP3A4TLR2
SCHEMBL16298540 0.81 KDM4E (0.44) LPAR5KDM4ECYP3A4CYP2D6
SCHEMBL29321208 0.81 KDM4E (0.37) LPAR5KDM4ECYP3A4CYP2D6
SCHEMBL23988623 0.81 LPAR5 (0.34) LPAR5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210340404-A1 SILANOL COMPOSITIONS AND METHODS OF USE 3M INNOVATIVE PROPERTIES COMPANY 2021-11-04 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-20210340404-A1 SILANOL COMPOSITIONS AND METHODS OF USE EPCAM, ITGA8, CD99 LPAR5 3116/4885KDM4E 985/4885ANPEP 635/4885

“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.