SCHEMBL26581990

SCHEMBL26581990

CCc1ccc(OC[C@H]2CC[C@H](CN)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 4/20 0.49
PARP10 Q53GL7 4/20 0.49
PARP2 Q9UGN5 2/20 0.49
TDP1 Q9NUW8 1/20 0.44
RORC P51449 1/20 0.43
GPR4 P46093 1/20 0.41
ACACB O00763 1/20 0.41
KDM1A O60341 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
SCHEMBL8273728 0.91 PARP15 (0.51) PARP15PARP10PARP2TDP1RORC
SCHEMBL14864495 0.85 HRH3 (0.51) PARP15PARP10PARP2TDP1RORC
SCHEMBL11941581 0.84 PARP15 (0.54) PARP15PARP10PARP2TDP1RORC
SCHEMBL9970995 0.84 PARP15 (0.54) PARP15PARP10PARP2TDP1RORC
SCHEMBL14508997 0.83 PARP15 (0.55) PARP15PARP10PARP2TDP1
SCHEMBL20766456 0.80 PARP15 (0.56) PARP15PARP10PARP2TDP1
SCHEMBL9813516 0.80 ACACB (0.53) PARP15PARP10PARP2TDP1RORC
SCHEMBL8285615 0.79 PARP15 (0.51) PARP15PARP10PARP2
SCHEMBL8284686 0.79 PARP15 (0.50) PARP15PARP10PARP2TDP1
SCHEMBL14451432 0.79 PARP15 (0.50) PARP15PARP10PARP2TDP1

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-20230331693-A1 GSPT1 COMPOUNDS AND METHODS OF USE OF THE NOVEL COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2023-10-19 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-20230331693-A1 GSPT1 COMPOUNDS AND METHODS OF USE OF THE NOVEL COMPOUNDS GSPT1, GSS, GSPT2 PARP15 1537/4885PARP10 1137/4885PARP2 1273/4885

“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.