SCHEMBL5128448

SCHEMBL5128448

OB(O)c1cccnc1OC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 11/20 0.37
SSTR1 P30872 8/20 0.37
DHODH Q02127 1/20 0.35
P2RY1 P47900 2/20 0.35
P2RY14 Q15391 2/20 0.35
TLR7 Q9NYK1 2/20 0.35
P2RY2 P41231 1/20 0.34
ABL1 P00519 1/20 0.34
ENPP2 Q13822 1/20 0.34

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
SCHEMBL30761883 1.00 SSTR4 (0.37) SSTR4SSTR1DHODHP2RY1P2RY14
SCHEMBL30672649 0.85 ENPP2 (0.34) SSTR4ENPP2
SCHEMBL896649 0.85 ENPP2 (0.34) SSTR4ENPP2
SCHEMBL12097746 0.81 SCN9A (0.41) SSTR4SSTR1
SCHEMBL29489857 0.79 ENPP2 (0.47) ENPP2
SCHEMBL4794 0.79 ENPP2 (0.47) ENPP2
SCHEMBL27194698 0.78 LIPE (0.36) ENPP2
SCHEMBL29057683 0.77 TRPV4 (0.36) ENPP2
Water SCHEMBL29953222 0.77 ENPP2 (0.45) ENPP2
Water SCHEMBL1543573 0.77 ENPP2 (0.45) ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240343741-A1 LEUCINE-RICH REPEAT KINASE 2 (LRRK2) INHIBITORS H. LUNDBECK A/S (DK) 2024-10-17 US disclosed
US-11958865-B1 Leucine-rich repeat kinase 2 (LRRK2) inhibitors H. LUNDBECK A/S (DK) 2024-04-16 US disclosed
WO-2024056775-A1 MACROCYCLIC LEUCINE-RICH REPEAT KINASE 2 (LRRK2) INHIBITORS H. LUNDBECK A/S (DK) 2024-03-21 WO disclosed
WO-2008021960-A2 TRIAZOLYL MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2008-02-21 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 (2 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-20240343741-A1 LEUCINE-RICH REPEAT KINASE 2 (LRRK2) INHIBITORS LRRK2, PARK7, PINK1 SSTR4 4764/4885SSTR1 4719/4885DHODH 3852/4885
US-11958865-B1 Leucine-rich repeat kinase 2 (LRRK2) inhibitors LRRK2, PARK7, PINK1 SSTR4 4764/4885SSTR1 4719/4885DHODH 3852/4885

“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.