SCHEMBL1884080

SCHEMBL1884080

CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc4cc(-c5cnc([C@@H]6CCCN6C(=O)OC(C)(C)C)n5COCC[Si](C)(C)C)cnc4c3)nc2)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 3/20 0.40
PRCP P42785 7/20 0.39
NR1I2 O75469 2/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2C9 P11712 3/20 0.36
CYP1A2 P05177 2/20 0.36
ABCB11 O95342 1/20 0.35
OPRK1 P41145 1/20 0.35
KCNH2 Q12809 1/20 0.35
OPRM1 P35372 2/20 0.34
OPRD1 P41143 2/20 0.34
CYP2D6 P10635 1/20 0.34
CHEK2 O96017 1/20 0.34

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
SCHEMBL932640 0.97 HPGDS (0.40) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL691385 0.88 HPGDS (0.48) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL691386 0.88 HPGDS (0.48) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL12661163 0.88 HPGDS (0.39) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL1884083 0.88 PRCP (0.36) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL1888626 0.87 DGAT1 (0.37) CHEK2
SCHEMBL1884026 0.87 PRCP (0.41) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL1884385 0.86 PRCP (0.40) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL12158987 0.86 PRCP (0.42) HPGDSPRCPNR1I2CYP3A4CYP2C9
SCHEMBL13293928 0.86 PRCP (0.42) HPGDSPRCPNR1I2CYP3A4CYP2C9

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-20110112100-A1 Hepatitis C Virus Inhibitors PFIZER INC. 2011-05-12 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-20110112100-A1 Hepatitis C Virus Inhibitors HAVCR2, SLC10A1, HCCS HPGDS 1869/4885PRCP 211/4885NR1I2 245/4885

“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.