SCHEMBL6542973

SCHEMBL6542973

CC(C)(C)OC(=O)N1CC(F)CC1(C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.37
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
EPHX2 P34913 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
RORC P51449 8/20 0.32
USP30 Q70CQ3 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL15114599 1.00 NR1H2 (0.37) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL2542297 1.00 NR1H2 (0.37) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL15114607 1.00 NR1H2 (0.37) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL1397570 1.00 NR1H2 (0.37) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL16409167 0.88 NR1H2 (0.34) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL15116741 0.88 NR1H2 (0.34) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL20054314 0.88 NR1H2 (0.34) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL19388507 0.88 NR1H2 (0.34) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL15116546 0.88 NR1H2 (0.34) NR1H2CHRM2CHRM1CHRM3EPHX2
SCHEMBL20221472 0.88 NR1H2 (0.34) NR1H2CHRM2CHRM1CHRM3EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326766-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2025-10-23 US disclosed
EP-4526300-A1 RIPK1 INHIBITORS AND METHODS OF USE Merck Sharp & Dohme LLC (US) 2025-03-26 EP disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
WO-2023225041-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-11-23 WO disclosed
US-6756378-B2 BENZYL -UREA, -THIOUREA, OR -GUANIDINE DERIVATIVES THAT INHIBIT THE BINDING OF LIGANDS TO ALPHA 4 BETA 1 INTEGRIN (VLA-4) PHARMACOPEIA DRUG DISCOVERY, INC. 2004-06-29 US disclosed
US-20030078249-A1 VLA-4 inhibitor compounds DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-04-24 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 (3 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-20030078249-A1 VLA-4 inhibitor compounds VCAM1, ICAM1, ITGA4 NR1H2 2538/4885CHRM2 2236/4885CHRM1 1416/4885
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 NR1H2 1585/4885CHRM2 4747/4885CHRM1 4677/4885
US-20250326766-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 NR1H2 1232/4885CHRM2 4710/4885CHRM1 4537/4885

“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.