SCHEMBL4964473

SCHEMBL4964473

COCCN(Cc1cn(Cc2ccc(F)cc2)c2cnc3c(c12)CCN(O)C3=O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PLA2G7 Q13093 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ KCNH2 Q12809 2/20 0.30
▸ REN P00797 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ HRH1 P35367 1/20 0.30

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
SCHEMBL4962825 0.90 ALDH1A1 (0.36) PLA2G7PKMKCNH2RENCYP2D6
SCHEMBL4964409 0.86 CYP2D6 (0.32) PLA2G7PKMKCNH2CYP2D6HRH1
SCHEMBL5427742 0.85 PKM (0.34) PKMCYP2D6
SCHEMBL4964833 0.84 HDAC1 (0.35) PKMKCNH2RENCYP2D6
SCHEMBL4962798 0.84 PKM (0.34) PKM
SCHEMBL4962138 0.83 PKM (0.34) PKMKCNH2CYP2D6HRH1
SCHEMBL4962838 0.83 CACNB4 (0.35) PKMCYP2D6
SCHEMBL4962762 0.82 P2RX7 (0.33) PLA2G7PKMKCNH2RENCYP2D6
SCHEMBL4962193 0.82 PKM (0.36) PKMKCNH2RENCYP2D6
SCHEMBL5421018 0.82 PKM (0.33) PKMCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934220-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME Pfizer Products Incorporated (US) 2008-06-25 — — EP disclosed
US-20070099915-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC. 2007-05-03 — — US disclosed
US-20070099915-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC. 2007-05-03 — — US disclosed
US-20070099915-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC. 2007-05-03 — — US disclosed
WO-2007042883-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER PRODUCTS INC. (US) 2007-04-19 — — WO disclosed
WO-2007042883-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER PRODUCTS INC. (US) 2007-04-19 — — WO 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-20070099915-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME IMPDH1, INTS9, TYMP PLA2G7 2248/4885PKM 1971/4885KCNH2 4108/4885

“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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