SCHEMBL6408724

SCHEMBL6408724

O=C(O)c1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCOc1ccc(C(F)(F)F)cn1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.40
SORT1 Q99523 1/20 0.36
LIPG Q9Y5X9 1/20 0.35
SCN9A Q15858 4/20 0.35
KMT2A Q03164 3/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 2/20 0.34
POLB P06746 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LIPE Q05469 1/20 0.34
SCN10A Q9Y5Y9 2/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
DAGLA Q9Y4D2 1/20 0.33

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
SCHEMBL4625368 0.92 GSTP1 (0.36) MRGPRX4SCN9AKMT2AMEN1LMNA
Pyridalyl SCHEMBL83386 0.90 KMT2A (0.39) MRGPRX4SCN9AKMT2ARAB9AMEN1
Pyridalyl SCHEMBL29354972 0.90 KMT2A (0.39) MRGPRX4SCN9AKMT2ARAB9AMEN1
SCHEMBL6417301 0.90 LMNA (0.42) MRGPRX4SCN9AKMT2AMEN1LMNA
SCHEMBL4624453 0.90 MRGPRX4 (0.38) MRGPRX4SCN9AKMT2AMEN1LMNA
SCHEMBL7076327 0.88 KMT2A (0.39) MRGPRX4SCN9AKMT2ARAB9AMEN1
SCHEMBL7074999 0.87 KMT2A (0.39) MRGPRX4SCN9AKMT2ARAB9AMEN1
SCHEMBL7078841 0.87 KMT2A (0.39) MRGPRX4SCN9AKMT2ARAB9AMEN1
SCHEMBL6415260 0.87 SCN9A (0.44) MRGPRX4SCN9ASCN10APPARD
SCHEMBL7075429 0.86 KMT2A (0.36) MRGPRX4SCN9AKMT2ALMNASMN1; SMN2

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
US-6949551-B2 Dihalopropene compounds, processes for their preparation, compositions comprising them and their use as pesticides BAYER CROPSCIENCE S.A. (FR) 2005-09-27 US disclosed
US-20040029886-A1 Dihalopropene compounds, processes for their preparation, compositions comprising them and their use as pesticides MERIAL, INC. 2004-02-12 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-20040029886-A1 Dihalopropene compounds, processes for their preparation, compositions comprising them and their use as pesticides DDT, CBR1, CBR3 MRGPRX4 3826/4885SORT1 4189/4885LIPG 4600/4885

“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.