SCHEMBL3672475

SCHEMBL3672475

C[C@@H](C(=O)O)N(C(=O)OC(C)(C)C)C1CCC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.36
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
HRH3 Q9Y5N1 1/20 0.31
HSD11B1 P28845 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL4996407 0.98 BTK (0.36) BTKKMT2ATSHR
SCHEMBL5131640 0.98 BTK (0.36) BTKKMT2ATSHR
SCHEMBL2712968 0.97 TSHR (0.37) BTKKMT2ATSHR
SCHEMBL9744380 0.97 TSHR (0.37) BTKKMT2ATSHR
SCHEMBL647264 0.97 TSHR (0.37) BTKKMT2ATSHR
SCHEMBL4328796 0.97 TSHR (0.37) BTKKMT2ATSHR
SCHEMBL9744375 0.97 TSHR (0.37) BTKKMT2ATSHR
Hydrochloric Acid SCHEMBL30546580 0.95 TSHR (0.36) BTKKMT2ATSHR
SCHEMBL2350718 0.95 KMT2A (0.34) BTKKMT2AHRH3HSD11B1
SCHEMBL2350728 0.95 KMT2A (0.34) BTKKMT2AHRH3HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118165069-A Nitrogen-containing spiro indoline compound, and preparation method and application thereof 深圳信立泰药业股份有限公司 2024-06-11 CN disclosed
US-8211897-B2 Inhibitors of cathepsin B VIROBAY, INC. (US) 2012-07-03 US disclosed
EP-2237793-A1 INHIBITORS OF CATHEPSIN B Virobay, Inc. (US) 2010-10-13 EP disclosed
WO-2009100225-A1 INHIBITORS OF CATHEPSIN B VIROBAY, INC. (US) 2009-08-13 WO disclosed
US-20090203629-A1 INHIBITORS OF CATHEPSIN B VIROBAY, INC. (US) 2009-08-13 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-20090203629-A1 INHIBITORS OF CATHEPSIN B CTSB, CSTB, CTSF BTK 4282/4885KMT2A 4689/4885TSHR 2321/4885

“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.