SCHEMBL3431669

SCHEMBL3431669

COC(=O)[C@H]1N(C(=O)OC(C)(C)C)C[C@@H](O[Si](C)(C)C(C)(C)C)C12CC2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.33
PDE4B Q07343 1/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
PTPN1 P18031 1/20 0.31

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
SCHEMBL3430059 0.87 PDE4B (0.33) CCR2PDE4BNR1H2NR1H3PTPN1
SCHEMBL883199 0.78 NR1H2 (0.35) CCR2PDE4BNR1H2NR1H3PTPN1
SCHEMBL5560650 0.72 EPHX1 (0.36) NR1H2NR1H3PTPN1
SCHEMBL2387781 0.72 P2RX3 (0.40) CCR2PDE4BNR1H2NR1H3PTPN1
SCHEMBL2954122 0.72 EPHX1 (0.36) NR1H2NR1H3PTPN1
SCHEMBL24826391 0.72 P2RX3 (0.40) CCR2PDE4BNR1H2NR1H3PTPN1
SCHEMBL24411297 0.72 EPHX1 (0.36) NR1H2NR1H3PTPN1
SCHEMBL1269514 0.72 P2RX3 (0.40) CCR2PDE4BNR1H2NR1H3PTPN1
SCHEMBL7456999 0.72 P2RX3 (0.40) CCR2PDE4BNR1H2NR1H3PTPN1
SCHEMBL142967 0.72 P2RX3 (0.40) CCR2PDE4BNR1H2NR1H3PTPN1

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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-04-19 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-20120095211-A1 SUBSTITUTED PROLINE INHIBITORS OF HEPATITIS C VIRUS REPLICATION VIP, EIF2AK2, PREP CCR2 533/4885PDE4B 1296/4885NR1H2 2556/4885

“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.