SCHEMBL21200939

SCHEMBL21200939

CNC(=S)NNC(=O)C(F)(F)C(C)(O)c1cccc(NC(=O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.58
GAA P10253 6/20 0.58
MAPT P10636 8/20 0.47
TDP1 Q9NUW8 4/20 0.47
NPSR1 Q6W5P4 3/20 0.47
LMNA P02545 5/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 1/20 0.41
HTT P42858 4/20 0.41
PLK4 O00444 2/20 0.41
DAPK3 O43293 2/20 0.41
RPS6KA5 O75582 2/20 0.41
MAP4K4 O95819 2/20 0.41
PIM1 P11309 2/20 0.41
PHKG2 P15735 2/20 0.41
CDK2 P24941 2/20 0.41
AXL P30530 2/20 0.41

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
SCHEMBL24660945 0.87 ALDH1A1 (0.54) ALDH1A1GAAMAPTTDP1NPSR1
SCHEMBL29640127 0.87 ALDH1A1 (0.54) ALDH1A1GAAMAPTTDP1NPSR1
SCHEMBL21200585 0.81 ALDH1A1 (0.51) ALDH1A1GAAMAPTLMNAMEN1
SCHEMBL28741733 0.78 GAA (0.42) ALDH1A1GAAMAPTTDP1LMNA
SCHEMBL21200277 0.74 ALDH1A1 (0.43) ALDH1A1GAAMAPTTDP1NPSR1
SCHEMBL17925886 0.73 MEN1 (0.57) ALDH1A1GAAMAPTNPSR1MEN1
Ammonia Solution, Strong SCHEMBL28873301 0.72 MAPT (0.55) ALDH1A1GAAMAPTNPSR1MEN1
SCHEMBL23213561 0.71 MEN1 (0.50) ALDH1A1GAAMAPTNPSR1LMNA
SCHEMBL2096025 0.70 MAPT (0.75) ALDH1A1GAAMAPTTDP1NPSR1
SCHEMBL2093458 0.70 HDAC8 (0.62) MAPTLMNAMEN1KMT2ASMN1; SMN2

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-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION NURIX THERAPEUTICS, INC. 2022-12-08 US disclosed
EP-3743063-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF Nurix Therapeutics, Inc. (US) 2020-12-02 EP disclosed
WO-2019148005-A1 INHIBITORS OF CBL-B AND METHODS OF USE THEREOF NURIX THERAPEUTICS, INC. (US) 2019-08-01 WO 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-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION CBLB, CBL, CBLC ALDH1A1 4274/4885GAA 467/4885MAPT 1811/4885

“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.