SCHEMBL25968720

SCHEMBL25968720

CCCC(C)(C)c1cc(F)cc(C#N)c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
PGR P06401 2/20 0.34
GRM5 P41594 1/20 0.33
EPAS1 Q99814 1/20 0.32

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
SCHEMBL22168989 0.86 GRM5 (0.35) PGRGRM5EPAS1
SCHEMBL20288417 0.82 CNR2 (0.33) CNR1CNR2
SCHEMBL11966001 0.78 KIF11 (0.44) PGRGRM5EPAS1
SCHEMBL21937268 0.76 CNR1 (0.32) CNR1CNR2PGR
SCHEMBL19040922 0.75 CNR2 (0.53) CNR1CNR2
SCHEMBL19251665 0.73 CYP11B2 (0.39) CNR1CNR2
SCHEMBL19232122 0.73 KIF11 (0.52) CNR1CNR2
SCHEMBL29837993 0.72 KIF11 (0.45) GRM5
SCHEMBL628008 0.72 KIF11 (0.45) GRM5
SCHEMBL23059386 0.71 CNR2 (0.39) CNR1CNR2

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-12030904-B2 Phospholipid compounds and uses thereof GILEAD SCIENCES, INC. (US) 2024-07-09 US disclosed
US-20230250117-A1 PHOSPHOLIPID COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. 2023-08-10 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 (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-12030904-B2 Phospholipid compounds and uses thereof PHOSPHO1, SGMS2, SGMS1 CNR1 1618/4885CNR2 1569/4885PGR 1552/4885
US-20230250117-A1 PHOSPHOLIPID COMPOUNDS AND USES THEREOF PHOSPHO1, SGMS2, SGMS1 CNR1 1618/4885CNR2 1569/4885PGR 1552/4885

“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.