SCHEMBL29314280

SCHEMBL29314280

C=CC1=C(C)CN(C(=O)OC(C)(C)C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 3/20 0.32
TGM2 P21980 3/20 0.32
TGM1 P22735 3/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
ELANE P08246 1/20 0.30
ESR2 Q92731 1/20 0.30
TGM3 Q08188 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL25040572 0.83 MEN1 (0.31)
SCHEMBL29314279 0.76 CHRM2 (0.33) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL29314278 0.75 HDAC1 (0.34) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL26538715 0.74 HDAC1 (0.33) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL13847977 0.72 CTSK (0.34) USP2SMN1; SMN2HDAC1HDAC6
SCHEMBL31218507 0.70 CHRM2 (0.44) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL25047142 0.70 HDAC1 (0.34) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL18612694 0.70 USP2 (0.32) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL4796997 0.69 CHRM2 (0.43) USP2SMN1; SMN2HDAC1HDAC6CHRM2
SCHEMBL18571170 0.69 USP2 (0.40) F13A1TGM2TGM1USP2SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239745-A1 METHOD FOR SYNTHESIZING BILIRUBIN Bilix Co., Ltd. (KR) 2024-07-18 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-20240239745-A1 METHOD FOR SYNTHESIZING BILIRUBIN CYP7A1, UGT1A3, UGT1A1 F13A1 987/4885TGM2 71/4885TGM1 48/4885

“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.