SCHEMBL22909827

SCHEMBL22909827

CC(C)CC(C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1cn(Cc2ccc(F)cc2)c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](C)C(=O)O[C@H](CCC#N)C(=O)O)N(C)C(=O)[C@@H](N)CC(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 7/20 0.38
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
THRB P10828 1/20 0.33
MMP2 P08253 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32
BCL2 P10415 1/20 0.32
BCL2L1 Q07817 1/20 0.32
MCL1 Q07820 1/20 0.32
LMNA P02545 1/20 0.32
APP P05067 1/20 0.32
SNCA P37840 1/20 0.32
POLB P06746 1/20 0.32
GHSR Q92847 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL22909775 1.00 ADAM17 (0.38) ADAM17KMT2AALDH1A1KDM4ETHRB
SCHEMBL22909635 0.96 KMT2A (0.37) ADAM17KMT2AALDH1A1KDM4ETHRB
SCHEMBL22909911 0.94 FNTA (0.36) ADAM17KMT2AALDH1A1KDM4ETHRB
SCHEMBL21431345 0.94 ADAM17 (0.40) ADAM17KMT2AALDH1A1KDM4ETHRB
SCHEMBL22909446 0.94 ADAM17 (0.32) ADAM17KMT2AALDH1A1KDM4ETHRB
SCHEMBL21431346 0.94 ADAM17 (0.39) ADAM17KMT2AMMP2MMP13MMP14
SCHEMBL22909625 0.93 ADAM17 (0.33) ADAM17KMT2AMMP2MMP13MMP14
SCHEMBL21431224 0.92 ADAM17 (0.31) ADAM17KMT2A
SCHEMBL21431347 0.91 ANPEP (0.32) KMT2AGHSR
SCHEMBL22909807 0.90 ADAM17 (0.40) ADAM17KMT2AMMP2MMP13MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339193-B2 CDP protein secretion inhibitors KEZAR LIFE SCIENCES (US) 2022-05-24 US disclosed
US-20210017233-A1 CDP PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2021-01-21 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-11339193-B2 CDP protein secretion inhibitors SEC61G, SEC61A1, SEC61B ADAM17 2360/4885KMT2A 4842/4885ALDH1A1 4805/4885
US-20210017233-A1 CDP PROTEIN SECRETION INHIBITORS SEC61G, SEC61A1, SEC61B ADAM17 2360/4885KMT2A 4842/4885ALDH1A1 4805/4885

“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.