SCHEMBL29330282

SCHEMBL29330282

CNC(=O)c1ccc([C@@H]2CCCCN2C(=O)OC(C)(C)C)s1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACKR3 P25106 1/20 0.42
NPC1 O15118 2/20 0.40
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 4/20 0.38
KDM1A O60341 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
TSHR P16473 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
UCHL1 P09936 1/20 0.36

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
SCHEMBL29330281 0.87 NPC1 (0.40) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL29477427 0.84 ACKR3 (0.39) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL24363847 0.84 ACKR3 (0.39) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL655760 0.84 NPC1 (0.44) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL655761 0.84 NPC1 (0.44) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL657227 0.83 NPC1 (0.43) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL657228 0.83 NPC1 (0.43) ACKR3NPC1LMNAL3MBTL1NPSR1
SCHEMBL29330250 0.81 UCHL1 (0.43) NPC1LMNAL3MBTL1NPSR1ALDH1A1
SCHEMBL15240571 0.77 UCHL1 (0.46) NPC1LMNAL3MBTL1NPSR1ALDH1A1
SCHEMBL22012903 0.74 MEN1 (0.41) NPC1LMNAL3MBTL1NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 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-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 ACKR3 762/4885NPC1 39/4885LMNA 1976/4885

“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.