SCHEMBL7527306

SCHEMBL7527306

CN(C)Cc1cc(C2(C)N=NNN2)ccc1Oc1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 0.51
SLC6A2 P23975 15/20 0.51
SLC6A3 Q01959 13/20 0.51
HTR2A P28223 5/20 0.51
KCNH2 Q12809 3/20 0.43

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
SCHEMBL9121785 0.69 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6151910 0.68 SLC6A4 (0.57) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6153377 0.64 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6151177 0.64 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6152457 0.64 SLC6A4 (0.54) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL5837316 0.60 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
Hydrochloric Acid SCHEMBL5878972 0.59 SLC6A4 (0.60) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL11576617 0.59 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6946976 0.59 SLC6A4 (0.72) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL5837104 0.59 SLC6A4 (0.74) SLC6A4SLC6A2SLC6A3HTR2AKCNH2

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-20020147206-A1 Combination treatment of multiple sclerosis (MS), other demyelinating conditions and peripheral neuropathy, especially painful neuropathies and diabetic neuropathy PFIZER INC. 2002-10-10 US claimed
US-20020099045-A1 Combination treatment for depression PFIZER PRODUCTS INC. 2002-07-25 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20020099045-A1 Combination treatment for depression HTR5A, HTR1A, OPRL1 SLC6A4 11/4885SLC6A2 18/4885SLC6A3 53/4885
US-20020147206-A1 Combination treatment of multiple sclerosis (MS), other demyelinating conditions and peripheral neuropathy, especially painful neuropathies and diabetic neuropathy PMP22, GAP43, SLC6A2 SLC6A4 4/4885SLC6A2 3/4885SLC6A3 36/4885

“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.