SCHEMBL4884851

SCHEMBL4884851

COC(=O)c1cccn1C(C)C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NR1H2 P55055 1/20 0.38
MAPK1 P28482 1/20 0.36
ELANE P08246 2/20 0.36
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 2/20 0.34
PKM P14618 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ITGA4 P13612 1/20 0.33
ITGB7 P26010 1/20 0.33
LMNA P02545 2/20 0.33

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
SCHEMBL4881106 0.82 CACNA1B (0.34) NR1H2MAPK1ELANENPC1RAB9A
SCHEMBL26205734 0.78 MAPK1 (0.43) CYP1A2CYP3A4CYP2C9CYP2C19MAPK1
SCHEMBL907526 0.75 LMNA (0.37) ELANEMAPTALDH1A1KDM4EITGA4
SCHEMBL14423544 0.74 ELANE (0.39) ELANEMAPTLMNA
SCHEMBL13279340 0.73 PTGS2 (0.44) CYP1A2CYP3A4CYP2C9CYP2C19MAPK1
SCHEMBL14164203 0.73 NR1H2 (0.47) NR1H2NPC1RAB9AMAPTPKM
SCHEMBL24966942 0.72 MAPK1 (0.62) CYP1A2CYP3A4CYP2C9CYP2C19MAPK1
SCHEMBL1966568 0.71 NR1H2 (0.39) NR1H2MAPK1NPC1RAB9AMAPT
SCHEMBL2124198 0.71 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL908480 0.70 NR1H2 (0.34) NR1H2MAPK1NPC1MAPTSMN1; 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-20080227774-A1 5,5-DISUBSTITUTED-INDOLIZINONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2008-09-18 US disclosed
US-20080227774-A1 5,5-DISUBSTITUTED-INDOLIZINONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2008-09-18 US disclosed
US-20080227774-A1 5,5-DISUBSTITUTED-INDOLIZINONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2008-09-18 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-20080227774-A1 5,5-DISUBSTITUTED-INDOLIZINONE COMPOUNDS CYP3A5, IPO5, IDO1 CYP1A2 49/4885CYP3A4 20/4885CYP2C9 61/4885

“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.