SCHEMBL7124112

SCHEMBL7124112

O=S(=O)(Nc1cccc(OC2CCN(c3ccncc3)CC2)c1)c1ccc2cc(Br)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.46
F10 P00742 12/20 0.45
HTR6 P50406 2/20 0.45
HTR1A P08908 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR7 P34969 1/20 0.45
DRD3 P35462 1/20 0.45
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
GHSR Q92847 1/20 0.41
LSS P48449 1/20 0.39

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
SCHEMBL5632729 0.92 F2 (0.55) F2F10HTR6HTR1AHTR2A
SCHEMBL7120480 0.90 KMT2A (0.47) F10HTR6HTR1AHTR2AHTR2C
SCHEMBL5633771 0.82 KMT2A (0.59) F2F10HTR6HTR1AHTR2A
SCHEMBL5632447 0.81 LSS (0.44) F10MAPTLSS
SCHEMBL6580787 0.80 GHSR (0.48) F2F10HTR6MAPTGHSR
SCHEMBL7115867 0.78 CYP3A4 (0.47) F10HTR6HTR1AHTR2AHTR2C
SCHEMBL6578432 0.78 F10 (0.46) F10MEN1ALDH1A1MAPTKMT2A
SCHEMBL7119668 0.77 F10 (0.42) F10LSS
SCHEMBL7112202 0.77 F10 (0.48) F2F10MEN1ALDH1A1MAPT
SCHEMBL5632002 0.74 ALDH1A1 (0.49) F2F10ALDH1A1KMT2AGHSR

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-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED 2003-11-06 US claimed
US-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED 2003-11-06 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-20030207882-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents F2, SERPINC1, F11 F2 1/4885F10 8/4885HTR6 3278/4885

“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.