SCHEMBL1834733

SCHEMBL1834733

Cc1cc(Cn2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)ccc1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 3/20 0.38
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 2/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
MAPT P10636 2/20 0.35
GPR55 Q9Y2T6 1/20 0.34
SKP2 Q13309 1/20 0.34
NPC1 O15118 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
KDM1A O60341 2/20 0.34
HDAC1 Q13547 2/20 0.34

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
SCHEMBL1831230 0.91 ALDH1A1 (0.44) ALDH1A1HTTNPSR1TDP1HSP90AA1
SCHEMBL1834668 0.90 GPR55 (0.46) ALDH1A1HTTNPSR1TDP1KDM4E
SCHEMBL1832898 0.79 KCNH2 (0.46) L3MBTL1MAPTMEN1KMT2ALMNA
SCHEMBL2161666 0.77 HSP90AA1 (0.34) HSP90AA1HSP90AB1GPR55SKP2MEN1
SCHEMBL1828348 0.76 HDAC6 (0.46) ALDH1A1L3MBTL1KDM4ESMN1; SMN2MAPT
SCHEMBL2161783 0.75 ALDH1A1 (0.41) ALDH1A1TDP1L3MBTL1KDM4ESMN1; SMN2
SCHEMBL5906334 0.75 ALDH1A1 (0.48) ALDH1A1TDP1L3MBTL1KDM4ESMN1; SMN2
SCHEMBL1835920 0.74 SMN1; SMN2 (0.36) ALDH1A1SMN1; SMN2SKP2NPC1RAB9A
SCHEMBL1832735 0.74 F11 (0.33) HSP90AA1HSP90AB1SKP2
SCHEMBL5905863 0.74 POLB (0.58) ALDH1A1HTTNPSR1HSP90AA1HSP90AB1

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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 ALDH1A1 928/4885HTT 3414/4885NPSR1 2948/4885

“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.