SCHEMBL26425317

SCHEMBL26425317

CB1OCc2cc(/C=C/c3ccccc3C(F)(F)F)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.38
NFKB1 P19838 1/20 0.37
BACE1 P56817 1/20 0.35
TNF P01375 3/20 0.34
RAB9A P51151 1/20 0.34
NOD1 Q9Y239 1/20 0.34
MAOB P27338 7/20 0.33
PDE4B Q07343 1/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
P4HB P07237 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
IL6 P05231 2/20 0.32
GAA P10253 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL26425456 0.85 CA1 (0.46) APPNFKB1BACE1PDE4B
SCHEMBL26425331 0.80 RELA (0.40) MAOBPDE4BNFE2L2
SCHEMBL26425307 0.80 NFE2L2 (0.52) MAOBLMNAMAPTMEN1KMT2A
SCHEMBL26425312 0.78 NFE2L2 (0.41) PDE4BNFE2L2
SCHEMBL26425314 0.76 PDE4B (0.38) PDE4BNFE2L2
SCHEMBL26425326 0.76 NFE2L2 (0.50) APPMAOBNFE2L2
SCHEMBL26425319 0.74 PDE4A (0.41) PDE4BMAPTNFE2L2
SCHEMBL26425329 0.74 RELA (0.44) MAOBPDE4BMAPTNFE2L2
SCHEMBL26425332 0.72 AHR (0.43) MAOBPDE4B
SCHEMBL26425309 0.72 CHAT (0.42) RAB9AMAOBPDE4BMAPTSMN1; SMN2

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-20230129381-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF ANTICANCER-DRUG RESISTANT CANCERS THE GEORGE WASHINGTON UNIVERSITY 2023-04-27 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-20230129381-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF ANTICANCER-DRUG RESISTANT CANCERS TP53, ANXA5, MCL1 APP 4061/4885NFKB1 2343/4885BACE1 3443/4885

“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.