SCHEMBL3589697

SCHEMBL3589697

CN(C1CCCCC1)C1Cc2ccc(N)cc2NC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 1/20 0.40
CRBN Q96SW2 4/20 0.35
DDB1 Q16531 3/20 0.35
MAPT P10636 3/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
PDE3B Q13370 5/20 0.32
PDE3A Q14432 5/20 0.32
PARP1 P09874 2/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 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
SCHEMBL3597785 0.90 PDE3B (0.36) CA9CRBNDDB1MAPTGAA
SCHEMBL13545487 0.88 CA9 (0.39) CA9CRBNDDB1MAPTGAA
SCHEMBL3589696 0.85 DDB1 (0.33) CRBNDDB1MAPTGAAMEN1
SCHEMBL13382926 0.83 S1PR1 (0.35) CRBNDDB1GAAMEN1KMT2A
SCHEMBL3595896 0.83 CA9 (0.47) CA9CRBNDDB1MAPTGAA
SCHEMBL13607023 0.79 CA9 (0.33) CA9MAPTGAAKDM4EMEN1
SCHEMBL3597784 0.78 PDE3B (0.36) CRBNDDB1MAPTGAAPDE3B
SCHEMBL3590237 0.76 CA9 (0.44) CA9CRBNMAPTGAAKDM4E
SCHEMBL3588367 0.76 CA9 (0.41) CA9CRBNDDB1MAPTGAA
SCHEMBL3584557 0.75 DDB1 (0.37) CRBNDDB1MAPTGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 CA9 1531/4885CRBN 762/4885DDB1 1855/4885

“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.