SCHEMBL3661654

SCHEMBL3661654

Fc1ccc(C2(CCl)OC2c2ccccc2Cl)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.33
HTR2C P28335 4/20 0.33
P2RX7 Q99572 2/20 0.33
BACE1 P56817 2/20 0.31
KCNN4 O15554 1/20 0.31
PTGS2 P35354 1/20 0.31
HCAR3 P49019 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
HTR2B P41595 2/20 0.30
SLC6A4 P31645 1/20 0.30

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
SCHEMBL1021798 0.90 MAPT (0.36) HTR2AHTR2CPTGS2HTR2B
SCHEMBL1498964 0.90 PSEN1 (0.35) HTR2AHTR2CP2RX7KCNN4
SCHEMBL1498984 0.89 BACE1 (0.36) HTR2AHTR2CBACE1KCNN4HCAR3
SCHEMBL14975607 0.88 P2RX7 (0.33) HTR2AHTR2CP2RX7BACE1KCNN4
SCHEMBL1498818 0.86 PTGS2 (0.32) HTR2AHTR2CPTGS2HTR2B
SCHEMBL1499074 0.84 HTR2C (0.33) HTR2AHTR2CP2RX7BACE1HTR2B
SCHEMBL3662849 0.84 DPP4 (0.35) HTR2A
SCHEMBL1498903 0.84 HTR2A (0.39) HTR2AHTR2CBACE1HTR2B
SCHEMBL1498880 0.84 BACE1 (0.41) HTR2CBACE1HTR2B
SCHEMBL6511952 0.81 KCNN4 (0.40) HTR2AHTR2CP2RX7KCNN4PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same BASF SE (DE) 2010-12-16 US claimed
US-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same BASF SE (DE) 2010-12-16 US disclosed
EP-2234488-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
WO-2009077443-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-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same XDH, NOX5, TET1 HTR2A 2148/4885HTR2C 2198/4885P2RX7 350/4885

“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.