SCHEMBL29001990

SCHEMBL29001990

COC(=O)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.58
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
USP30 Q70CQ3 3/20 0.52
ALDH1A1 P00352 2/20 0.48
UCHL1 P09936 3/20 0.46
SCN4A P35499 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
SCN5A Q14524 1/20 0.44
SCN3A Q9NY46 1/20 0.44
JAK2 O60674 1/20 0.43
KDM4E B2RXH2 3/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 2/20 0.43
HSD17B10 Q99714 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL29001992 1.00 NPC1 (0.58) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL27134353 0.93 NPC1 (0.59) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL26976715 0.93 NPC1 (0.59) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL655760 0.79 NPC1 (0.44) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL655761 0.79 NPC1 (0.44) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL30447445 0.78 USP30 (0.48) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL17474759 0.76 NPC1 (0.80) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL17474788 0.76 NPC1 (0.80) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL2389717 0.76 NPC1 (0.77) NPC1LMNANPSR1L3MBTL1MEN1
SCHEMBL2525285 0.76 NPC1 (0.77) NPC1LMNANPSR1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858925-B2 GAS41 inhibitors and methods of use thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-01-02 US disclosed
EP-4178571-A1 GAS41 INHIBITORS AND METHODS OF USE THEREOF The Regents Of The University Of Michigan (US) 2023-05-17 EP disclosed
CN-116113406-A GAS41 inhibitors and methods of use thereof 密歇根大学董事会 2023-05-12 CN 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-11858925-B2 GAS41 inhibitors and methods of use thereof GAS6, HIF1AN, TMEM41B NPC1 3567/4885LMNA 4501/4885NPSR1 2583/4885

“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.