SCHEMBL10174635

SCHEMBL10174635

CNC(C)C(=O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
POLB P06746 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
SCHEMBL14300996 1.00 L3MBTL1 (0.32) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL12420353 1.00 L3MBTL1 (0.32) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL14010448 0.76 SLC6A3 (0.42) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL21120312 0.76 TDP1 (0.35) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL14275444 0.76 TDP1 (0.35) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL23065774 0.76 TDP1 (0.35) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL8219435 0.76 CA2 (0.38) POLB
SCHEMBL14601332 0.76 SLC6A3 (0.42) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL18653492 0.76 SLC6A3 (0.42) L3MBTL1GAAHSP90AA1MAPTGPR55
SCHEMBL3047902 0.75 ALDH1A1 (0.38)

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
EP-3433243-B1 NOVEL DERIVATIVES AND THEIR USE AS SELECTIVE INHIBITORS OF CASPASE-2 INST NAT SANTE RECH MED (FR) 2021-09-08 EP disclosed
US-10626144-B2 Peptide derivatives and uses thereof NOSOPHARM (FR) 2020-04-21 US disclosed
WO-2019163958-A1 DRUG COMPOSITE, MICELLE, AND PHARMACEUTICAL COMPOSITION 公益財団法人川崎市産業振興財団 2019-08-29 WO disclosed
US-20170298097-A1 Peptide Derivatives and Uses Thereof NOSOPHARM (FR) 2017-10-19 US disclosed
US-20140135254-A1 THERAPEUTIC PEPTIDE-POLYMER CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2014-05-15 US disclosed
US-20120052097-A1 THERAPEUTIC PEPTIDE-POLYMER CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-03-01 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 (4 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-10626144-B2 Peptide derivatives and uses thereof VIP, IAPP, NGLY1 L3MBTL1 1817/4885GAA 1526/4885HSP90AA1 1678/4885
US-20120052097-A1 THERAPEUTIC PEPTIDE-POLYMER CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS IAPP, PSAP, LNPEP L3MBTL1 2017/4885GAA 194/4885HSP90AA1 640/4885
US-20170298097-A1 Peptide Derivatives and Uses Thereof VIP, IAPP, NGLY1 L3MBTL1 1817/4885GAA 1526/4885HSP90AA1 1678/4885
US-20140135254-A1 THERAPEUTIC PEPTIDE-POLYMER CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS IAPP, PSAP, LNPEP L3MBTL1 2017/4885GAA 194/4885HSP90AA1 640/4885

“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.