SCHEMBL3466709

SCHEMBL3466709

Fc1ccc(C=C(CBr)c2ccccc2)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 3/20 0.37
MAPT P10636 3/20 0.37
RAB9A P51151 3/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
HTT P42858 2/20 0.36
HPGD P15428 1/20 0.36
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
GRM2 Q14416 1/20 0.33
PDPK1 O15530 1/20 0.33
NFE2L2 Q16236 1/20 0.33
PTPN1 P18031 1/20 0.33
GSK3B P49841 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
SCHEMBL3466707 1.00 SMN1; SMN2 (0.37) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL3466010 0.91 PTPN1 (0.40) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL3466008 0.91 PTPN1 (0.40) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL3465809 0.88 GSK3B (0.38) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL3465810 0.88 GSK3B (0.38) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL3467390 0.85 PDPK1 (0.45) MAPTCYP1A2CYP2C19HTTPDPK1
SCHEMBL3467387 0.85 PDPK1 (0.45) MAPTCYP1A2CYP2C19HTTPDPK1
SCHEMBL3465871 0.82 GABRA1 (0.41) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL3465868 0.82 GABRA1 (0.41) SMN1; SMN2NPC1MAPTRAB9ACYP1A2
SCHEMBL9733978 0.82 MAPT (0.47) SMN1; SMN2NPC1MAPTRAB9AHTT

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-20100273651-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same BASF SE (DE) 2010-10-28 US disclosed
EP-2235005-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
WO-2009077500-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 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-20100273651-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same XDH, SQOR, NOX5 SMN1; SMN2 2481/4885NPC1 4700/4885MAPT 3863/4885

“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.