SCHEMBL26425319

SCHEMBL26425319

CB1OCc2cc(/C=C/c3ccc(C)cc3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
NFE2L2 Q16236 7/20 0.41
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
ALOX5 P09917 1/20 0.38
RELA Q04206 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35

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
SCHEMBL26425331 0.88 RELA (0.40) PDE4APDE4BPDE4CPDE4DNFE2L2
SCHEMBL26425329 0.87 RELA (0.44) PDE4APDE4BPDE4CPDE4DNFE2L2
SCHEMBL26425459 0.83 PDE4B (0.61) PDE4APDE4BPDE4CPDE4DNFE2L2
SCHEMBL26425332 0.82 AHR (0.43) PDE4APDE4BPDE4CPDE4DPTGS1
SCHEMBL26425309 0.82 CHAT (0.42) PDE4APDE4BPDE4CPDE4DPTGS2
SCHEMBL10053217 0.81 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DCA1
SCHEMBL26425312 0.80 NFE2L2 (0.41) PDE4APDE4BPDE4CPDE4DNFE2L2
SCHEMBL26425326 0.80 NFE2L2 (0.50) NFE2L2PTGS1PTGS2RELACA1
SCHEMBL26425328 0.80 RELA (0.46) NFE2L2RELACYP1A2CYP2C9
SCHEMBL26425323 0.77 RELA (0.54) NFE2L2RELATUBB4ATUBBTUBA3C

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 PDE4A 3402/4885PDE4B 2973/4885PDE4C 2702/4885

“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.