SCHEMBL12215338

SCHEMBL12215338

CCOC(=O)c1ccc(OC)c2c(C(=O)C(C)=O)c[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CLEC4M Q9H2X3 1/20 0.47
▸ DPP4 P27487 1/20 0.46
▸ JAK3 P52333 6/20 0.43
▸ JAK2 O60674 4/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 2/20 0.39
▸ CDC25B P30305 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL12215333 0.83 KDM4E (0.47) CYP1A2CYP3A4MAPTGAAKDM4E
SCHEMBL12215330 0.83 CYP3A4 (0.41) CYP3A4MAPTGAAKDM4ELMNA
SCHEMBL12215340 0.79 GAA (0.43) CYP3A4MAPTGAAKDM4ELMNA
SCHEMBL9829849 0.78 CLEC4M (0.56) CLEC4MDPP4JAK3JAK2CYP1A2
SCHEMBL12215320 0.78 CYP3A4 (0.41) CYP1A2CYP3A4CYP2C19MAPTKDM4E
SCHEMBL13555236 0.78 CYP3A4 (0.41) CYP1A2CYP3A4CYP2C19MAPTGAA
SCHEMBL12215433 0.74 ALDH1A1 (0.43) CYP3A4MAPTKDM4ESMN1; SMN2
SCHEMBL397393 0.74 CLEC4M (0.52) CLEC4MDPP4JAK3JAK2CYP1A2
SCHEMBL62162 0.74 CLEC4M (0.52) CLEC4MDPP4JAK3JAK2CYP1A2
SCHEMBL7291947 0.73 CLEC4M (0.54) CLEC4MDPP4JAK3JAK2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039486-B2 Viricides, immunomodulators or HIV entry inhibitors; lymphadenopathy associated virus, human T-cell leukemia/lymphoma virus; AIDS BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-18 — — US disclosed
US-20080132516-A1 INDOLE, AZAINDOLE AND RELATED HETEROCYCLIC N-SUBSTITUTED PIPERAZINE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY 2008-06-05 — — 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-20080132516-A1 INDOLE, AZAINDOLE AND RELATED HETEROCYCLIC N-SUBSTITUTED PIPERAZINE DERIVATIVES IDO2, IDO1, INMT CLEC4M 2379/4885DPP4 1121/4885JAK3 1100/4885

“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.

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