SCHEMBL25845395

SCHEMBL25845395

CCC1=C(c2ccc(OCc3ccccc3)cc2)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 8/20 0.49
YAP1 P46937 3/20 0.47
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOB P27338 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
NR4A1 P22736 1/20 0.41
NR4A2 P43354 1/20 0.41
NR4A3 Q92570 1/20 0.41
LTA4H P09960 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL20475182 0.95 PRMT5 (0.48) PRMT5YAP1MAOBGPR119NR4A1
SCHEMBL23040400 0.85 PRMT5 (0.46) PRMT5YAP1MAPT
SCHEMBL25845320 0.83 GPR119 (0.47) KDM4EMEN1MAPTKMT2AGPR119
SCHEMBL25845399 0.82 ESR2 (0.46) KDM4EMAPTGPR119MAPK1
SCHEMBL20475154 0.81 GPR119 (0.42) PRMT5YAP1MAOBGPR119MAPK1
SCHEMBL1750649 0.78 CHRM5 (0.48) PRMT5YAP1MAPK1
SCHEMBL20475212 0.77 GPR119 (0.47) KDM4EMEN1MAPTKMT2AGPR119
SCHEMBL27114057 0.76 YAP1 (0.56) PRMT5YAP1MEN1KMT2AGPR119
SCHEMBL18550027 0.76 PRMT5 (0.51) PRMT5YAP1GPR119MAPK1
SCHEMBL8195218 0.76 NAMPT (0.57) PRMT5YAP1GPR119

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-20230303531-A1 5-MEMBERED AZA-HETEROCYCLIC CONTAINING DELTA-OPIOID RECEPTOR MODULATING COMPOUNDS, METHODS OF USING AND MAKING THE SAME TREVENA, INC. 2023-09-28 US disclosed
US-11702408-B2 5-membered aza-heterocyclic containing delta-opioid receptor modulating compounds, methods of using and making the same TREVENA, INC. (US) 2023-07-18 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-11702408-B2 5-membered aza-heterocyclic containing delta-opioid receptor modulating compounds, methods of using and making the same OPRD1, OPRM1, OPRK1 PRMT5 526/4885YAP1 1693/4885KDM4E 827/4885
US-20230303531-A1 5-MEMBERED AZA-HETEROCYCLIC CONTAINING DELTA-OPIOID RECEPTOR MODULATING COMPOUNDS, METHODS OF USING AND MAKING THE SAME OPRD1, OPRM1, OPRK1 PRMT5 479/4885YAP1 1539/4885KDM4E 729/4885

“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.