SCHEMBL23537293

SCHEMBL23537293

CC(C)CNC1CCCc2[nH]c(=O)c3ccccc3c21

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.43
TNKS O95271 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ADRB2 P07550 2/20 0.33
ADRB1 P08588 2/20 0.33

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
SCHEMBL29824164 1.00 PARP1 (0.43) PARP1TNKSTNKS2NFKB1NFKB2
SCHEMBL29824425 1.00 PARP1 (0.43) PARP1TNKSTNKS2NFKB1NFKB2
SCHEMBL30023263 1.00 PARP1 (0.43) PARP1TNKSTNKS2NFKB1NFKB2
SCHEMBL30023596 0.92 TNKS (0.40) PARP1TNKSTNKS2NFKB1NFKB2
SCHEMBL23537227 0.92 TNKS (0.40) PARP1TNKSTNKS2NFKB1NFKB2
SCHEMBL29824451 0.92 TNKS (0.40) PARP1TNKSTNKS2NFKB1NFKB2
SCHEMBL23537417 0.85 PARP1 (0.41) PARP1
SCHEMBL29824412 0.85 PARP1 (0.41) PARP1
SCHEMBL23537222 0.83 PARP1 (0.49) PARP1TNKSTNKS2KDM4EALDH1A1
SCHEMBL29824229 0.83 PARP1 (0.49) PARP1TNKSTNKS2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230108906-A1 SUBSTITUTED BICYCLIC AND TRICYCLIC UREAS AND AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2023-04-06 US disclosed
EP-4076648-A1 SUBSTITUTED BICYCLIC AND TRICYCLIC UREAS AND AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2022-10-26 EP disclosed
CN-115087486-A Substituted bicyclic and tricyclic ureas and amides, analogs thereof, and methods of use thereof 爱彼特生物制药公司 2022-09-20 CN disclosed
WO-2021127356-A1 Substituted Bicyclic and Tricyclic Ureas and Amides, Analogues Thereof, and Methods Using Same ARBUTUS BIOPHARMA, INC. (US) 2021-06-24 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-20230108906-A1 SUBSTITUTED BICYCLIC AND TRICYCLIC UREAS AND AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME DDC, CDA, HMBS PARP1 2241/4885TNKS 2559/4885TNKS2 3385/4885

“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.