SCHEMBL1361761

SCHEMBL1361761

O=C(c1cc(Br)[c]c(Br)c1)N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 13/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 4/20 0.53
TSHR P16473 1/20 0.50
HSD11B1 P28845 1/20 0.50
SERPINE1 P05121 1/20 0.46
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPK1 P28482 2/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL3389201 0.80 HPGD (0.68) HPGDKDM4EALDH1A1TSHRHSD11B1
SCHEMBL3455576 0.78 HPGD (0.66) HPGDKDM4EALDH1A1TSHRHSD11B1
SCHEMBL29632673 0.77 HPGD (0.56) HPGDKDM4EALDH1A1TSHRHSD11B1
SCHEMBL1495677 0.74 HPGD (0.60) HPGDKDM4EALDH1A1TSHRHSD11B1
SCHEMBL971083 0.72 HPGD (1.00) HPGDALDH1A1TSHRMAPK1
SCHEMBL12569437 0.72 HPGD (0.96) HPGDKDM4EALDH1A1TSHRHSD11B1
SCHEMBL2014694 0.72 KDM4E (1.00) HPGDKDM4EALDH1A1HSD11B1SERPINE1
SCHEMBL10721733 0.72 HPGD (0.95) HPGDKDM4EALDH1A1TSHRMAPK1
SCHEMBL18734483 0.72 HPGD (0.57) HPGDKDM4EALDH1A1TSHRHSD11B1
SCHEMBL24185725 0.71 HPGD (0.96) HPGDALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067638-B2 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2011-11-29 US disclosed
US-20090233962-A1 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2009-09-17 US disclosed
EP-1911751-A1 AMIDE DERIVATIVE AND PESTICIDE CONTAINING SUCH COMPOUND Mitsui Chemicals, Inc. (JP) 2008-04-16 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-20090233962-A1 Amide derivative and insecticide containing the same CYP1A1, CYP4B1, CYP2E1 HPGD 2086/4885KDM4E 496/4885ALDH1A1 427/4885

“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.