SCHEMBL23943707

SCHEMBL23943707

CCC(C)COC(=O)Nc1ccc(Cc2ccc(OC#N)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 2/20 0.42
UBA2 Q9UBT2 2/20 0.42
RAB9A P51151 7/20 0.41
NPC1 O15118 6/20 0.41
HPGD P15428 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
ALDH1A1 P00352 5/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
MCL1 Q07820 1/20 0.38
CYP1A2 P05177 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
SCHEMBL18844746 0.82 HPGD (0.57) SAE1UBA2RAB9ANPC1HPGD
SCHEMBL19043004 0.81 SAE1 (0.55) SAE1UBA2RAB9ANPC1HPGD
SCHEMBL22550502 0.79 SMN1; SMN2 (0.59) SAE1UBA2RAB9ANPC1HPGD
SCHEMBL22550572 0.79 SMN1; SMN2 (0.59) SAE1UBA2RAB9ANPC1HPGD
SCHEMBL22793353 0.79 SMN1; SMN2 (0.59) SAE1UBA2RAB9ANPC1HPGD
SCHEMBL14668125 0.77 TSHR (0.56) SAE1UBA2RAB9AHPGDSMN1; SMN2
SCHEMBL19216513 0.77 SAE1 (0.64) SAE1UBA2RAB9ANPC1SMN1; SMN2
SCHEMBL22550493 0.76 SMN1; SMN2 (0.52) RAB9ANPC1HPGDSMN1; SMN2L3MBTL1
SCHEMBL22550562 0.76 SMN1; SMN2 (0.52) RAB9ANPC1HPGDSMN1; SMN2L3MBTL1
SCHEMBL22550530 0.76 SMN1; SMN2 (0.52) RAB9ANPC1HPGDSMN1; SMN2L3MBTL1

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-20210324132-A1 OXAZOLIDINEDIONE-TERMINATED PREPOLYMER HUNTSMAN INTERNATIONAL LLC 2021-10-21 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 (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-20210324132-A1 OXAZOLIDINEDIONE-TERMINATED PREPOLYMER HPD, PCNA, HAAO SAE1 4039/4885UBA2 1412/4885RAB9A 3111/4885

“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.