SCHEMBL4220147

SCHEMBL4220147

COC(=O)[C@H]1C[C@@H](C(=O)OC(C)(C)C)C1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.48
CHRNA4 P43681 2/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA7 P36544 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.41
DGAT1 O75907 1/20 0.40
BRD4 O60885 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
BTK Q06187 1/20 0.39
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35

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
SCHEMBL3643987 1.00 CHRNB2 (0.48) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL3643983 1.00 CHRNB2 (0.48) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL4228795 0.92 SMN1; SMN2 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL3640335 0.92 SMN1; SMN2 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL3646231 0.92 SMN1; SMN2 (0.42) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL1298062 0.91 HRH3 (0.43) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL1296894 0.88 BTK (0.49) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL1296457 0.87 SMN1; SMN2 (0.49) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL10210925 0.87 SMN1; SMN2 (0.49) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7
SCHEMBL1297555 0.83 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3CHRNA7

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-20250257075-A1 MACROCYCLIC INHIBITORS OF KRAS FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2025-08-14 US disclosed
CN-119546612-A Macrocyclic inhibitors of KRAS for the treatment of cancer 豪夫迈·罗氏有限公司 2025-02-28 CN disclosed
US-8324396-B2 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor AMGEN INC. (US) 2012-12-04 US disclosed
US-20090054463-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor AMGEN INC. 2009-02-26 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 (2 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-20090054463-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor UTS2R, CASR, GPR17 CHRNB2 2910/4885CHRNA4 2640/4885CHRNB4 3256/4885
US-20250257075-A1 MACROCYCLIC INHIBITORS OF KRAS FOR THE TREATMENT OF CANCER KRAS, NRAS, HRAS CHRNB2 4853/4885CHRNA4 4877/4885CHRNB4 4871/4885

“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.