SCHEMBL13879320

SCHEMBL13879320

CN1CCC2(CCNC2=O)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OTUD7B Q6GQQ9 1/20 0.57
CDK8 P49336 7/20 0.38
CCNC P24863 6/20 0.38
JAK1 P23458 3/20 0.36
TYK2 P29597 3/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
CDK19 Q9BWU1 2/20 0.36
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
WNT3A P56704 1/20 0.35
PRKCQ Q04759 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM3 P20309 1/20 0.35
LRRK2 Q5S007 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
RORC P51449 1/20 0.34

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
SCHEMBL22172615 1.00 OTUD7B (0.57) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL20414626 1.00 OTUD7B (0.57) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL24859554 0.89 OTUD7B (0.50) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL14377176 0.89 OTUD7B (0.50) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL5559483 0.88 OTUD7B (0.51) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL23260107 0.86 OTUD7B (0.49) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL16562302 0.82 OTUD7B (0.39) OTUD7BCHRM2CHRM3NEK2
SCHEMBL16750994 0.81 OTUD7B (0.42) OTUD7BCDK8CCNCCDK19GRIN1
SCHEMBL2605421 0.77 OTUD7B (0.41) OTUD7BCDK8CCNCJAK1TYK2
SCHEMBL24718639 0.77 OTUD7B (0.53) OTUD7BCDK8CCNCJAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024081363-A1 COMPOSITION COMPRISING A FIRST RAS INHIBITOR, SECOND RAS INHIBITOR AND A SHP2 INHIBITOR FOR USE IN THE TREATMENT OF CANCER Revolution Medicines, Inc. (US) 2024-04-18 WO disclosed
US-20230374035-A1 RAS INHIBITORS Revolution Medicines, Inc. 2023-11-23 US disclosed
EP-3344624-B1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI INC (US) 2023-10-25 EP disclosed
US-20210130369-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2021-05-06 US disclosed
US-10781204-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-09-22 US disclosed
WO-2019111218-A1 NOVEL HETEROCYCLIC COMPOUNDS AS IRAK4 INHIBITORS CADILA HEALTHCARE LIMITED (IN) 2019-06-13 WO disclosed
US-20170066763-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-03-09 US disclosed
US-20090111805-A1 BICYCLIC HETEROAROMATIC DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. 2009-04-30 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 (5 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-20170066763-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 OTUD7B 1335/4885CDK8 395/4885CCNC 3303/4885
US-20090111805-A1 BICYCLIC HETEROAROMATIC DERIVATIVES USEFUL AS ANTICANCER AGENTS CCNB1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNY OTUD7B 1482/4885CDK8 614/4885CCNC 33/4885
US-20230374035-A1 RAS INHIBITORS KRAS, NRAS, HRAS OTUD7B 2098/4885CDK8 301/4885CCNC 324/4885
US-20210130369-A1 RAS INHIBITORS KRAS, NRAS, HRAS OTUD7B 2098/4885CDK8 301/4885CCNC 324/4885
US-10781204-B2 TYK2 inhibitors and uses thereof TYK2, JAK1, JAK2 OTUD7B 1643/4885CDK8 434/4885CCNC 2955/4885

“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.