SCHEMBL23978901

SCHEMBL23978901

CC(C)C1c2ccccc2C[C@H]1OCCF

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 5/20 0.40
OPRM1 P35372 2/20 0.35
OPRK1 P41145 2/20 0.35
PRCP P42785 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
KDM1A O60341 3/20 0.32
HTR2A P28223 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
SCHEMBL26996818 0.88 OPRM1 (0.37) OPRM1OPRK1PRCPSIGMAR1KDM1A
SCHEMBL26269491 0.87 CRHR1 (0.38) CRHR1OPRM1OPRK1PRCPSIGMAR1
SCHEMBL26996825 0.87 BIRC2 (0.37) OPRM1OPRK1PRCPSIGMAR1KDM1A
SCHEMBL18289331 0.85 NTRK1 (0.39) OPRM1OPRK1PRCPSIGMAR1
SCHEMBL22808490 0.82 OPRM1 (0.33) OPRM1OPRK1PRCPSIGMAR1
SCHEMBL22456647 0.81 BIRC2 (0.35) OPRM1OPRK1PRCPSIGMAR1
SCHEMBL26996828 0.81 OPRM1 (0.36) OPRM1OPRK1PRCPSIGMAR1
SCHEMBL23979191 0.80 CRHR1 (0.42) CRHR1OPRM1PRCPMAOBMAOA
SCHEMBL23978833 0.79 CRHR1 (0.43) CRHR1MAOBMAOAKDM1A
SCHEMBL10283336 0.78 OPRM1 (0.41) OPRM1OPRK1PRCPSIGMAR1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295181-A1 INHIBITOR OF APOPTOSIS (IAP) PROTEIN ANTAGONISTS Sanford Burnham Prebys Medical Discovery Institute 2023-09-21 US disclosed
US-20230295181-A1 INHIBITOR OF APOPTOSIS (IAP) PROTEIN ANTAGONISTS Sanford Burnham Prebys Medical Discovery Institute 2023-09-21 US disclosed
WO-2021222614-A1 INHIBITOR OF APOPTOSIS (IAP) PROTEIN ANTAGONISTS Sanford Burnham Prebys Medical Discovery Institute (US) 2021-11-04 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 (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-20230295181-A1 INHIBITOR OF APOPTOSIS (IAP) PROTEIN ANTAGONISTS API5, XIAP, BIRC5 CRHR1 4419/4885OPRM1 4721/4885OPRK1 4661/4885

“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.