SCHEMBL1994282

SCHEMBL1994282

CCCC(=O)NCc1ccc(Br)cc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
P2RX7 Q99572 6/20 0.43
ALDH1A1 P00352 1/20 0.42
PPARG P37231 1/20 0.42

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
SCHEMBL1986824 0.89 EPHX2 (0.47) EPHX2P2RX7PPARG
SCHEMBL1988687 0.86 EPHX2 (0.50) EPHX2P2RX7PPARG
SCHEMBL27890400 0.84 EPHX2 (0.40) EPHX2MEN1KMT2AP2RX7
SCHEMBL1987352 0.83 EPHX2 (0.43) EPHX2MEN1KMT2AP2RX7
SCHEMBL1988822 0.83 SETDB1 (0.49) EPHX2P2RX7
SCHEMBL1871892 0.83 EPHX2 (0.43) EPHX2KMT2AP2RX7
SCHEMBL1872511 0.82 P2RX7 (0.44) EPHX2P2RX7PPARG
SCHEMBL1884357 0.81 EPHX2 (0.47) EPHX2P2RX7PPARG
SCHEMBL1871724 0.81 EPHX2 (0.42) EPHX2P2RX7
SCHEMBL24521599 0.80 MEN1 (0.59) EPHX2MEN1KMT2AP2RX7ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102666505-A Pesticidal heterocyclic compounds BAYER CROPSCIENCE AG 2012-09-12 CN disclosed
US-20110152332-A1 Pesticidal Heterocyclic Compounds BAYER CROPSCIENCE AG (DE) 2011-06-23 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-20110152332-A1 Pesticidal Heterocyclic Compounds DDT, PTMS, CYP4X1 EPHX2 1725/4885MEN1 510/4885KMT2A 817/4885

“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.