SCHEMBL4913181

SCHEMBL4913181

CCn1c(=O)n(C)c(=O)c2c(C(=O)N(C)OC)c(CCc3ccnc4ccccc34)sc21

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 18/20 0.49
CYP2C9 P11712 10/20 0.47
CYP3A4 P08684 9/20 0.47
SLC16A7 O60669 1/20 0.47
ABCB11 O95342 1/20 0.45
ADORA2B P29275 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
RXFP1 Q9HBX9 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
SCHEMBL4804324 0.93 SLC16A1 (0.58) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4920821 0.91 SLC16A1 (0.49) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4804904 0.87 SLC16A1 (0.57) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4796666 0.84 SLC16A1 (0.70) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4804234 0.84 SLC16A1 (0.56) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4802442 0.83 SLC16A1 (0.57) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4913175 0.82 SLC16A1 (0.45) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL5789805 0.81 SLC16A1 (0.52) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4801580 0.80 SLC16A1 (0.57) SLC16A1CYP2C9CYP3A4SLC16A7ABCB11
SCHEMBL4797256 0.78 SLC16A1 (0.60) SLC16A1CYP2C9CYP3A4SLC16A7ALDH1A1

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-20080153855-A1 Thieno[2,3-d]pyrimidinedione derivatives; antiproliferative agents against T-cells; chronic obstructive pulmonary disease, asthma; immunosuppressants, antihistamines, bronchodilator agents, and anticarcinogenic agents ASTRAZENECA AB, A SWEDEN CORPORATION 2008-06-26 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-20080153855-A1 Thieno[2,3-d]pyrimidinedione derivatives; antiproliferative agents against T-cells; chronic obstructive pulmonary disease, asthma; immunosuppressants, antihistamines, bronchodilator agents, and anticarcinogenic agents HRH4, HRH2, HRH3 SLC16A1 4716/4885CYP2C9 682/4885CYP3A4 397/4885

“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.