SCHEMBL6370612

SCHEMBL6370612

CSc1ccc(Cc2cnccc2CN(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 16/20 0.66
SLC6A2 P23975 6/20 0.66
SLC6A3 Q01959 6/20 0.66
HTR2A P28223 1/20 0.40
KCNH2 Q12809 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 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
SCHEMBL6369492 0.94 SLC6A4 (0.66) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6365203 0.81 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3
SCHEMBL6364445 0.78 SLC6A4 (0.65) SLC6A4SLC6A2SLC6A3
SCHEMBL6364794 0.78 SLC6A4 (0.63) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6365131 0.78 SLC6A4 (0.63) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL5878607 0.74 SLC6A4 (0.80) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL5878517 0.74 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6276352 0.72 KDM4C (0.45) SLC6A4SLC6A2SLC6A3
SCHEMBL24047163 0.71 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3HTR2AKCNH2
SCHEMBL6370115 0.70 FTO (0.47) SLC6A4SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6800652-B2 SELECTIVE SEROTONIN RE-UPTAKE INHIBITORS PFIZER INC. 2004-10-05 US claimed
US-20040097509-A1 Diaryl compounds PFIZER INC. 2004-05-20 US claimed
US-20050026920-A1 Selective serotonin re-uptake inhibitors; use in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder, post-traumatic stress disorder, substance abuse disorders and sexual dysfunction PFIZER INC 2005-02-03 US disclosed
US-6800652-B2 SELECTIVE SEROTONIN RE-UPTAKE INHIBITORS PFIZER INC. 2004-10-05 US disclosed
US-20040097509-A1 Diaryl compounds PFIZER INC. 2004-05-20 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 (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-20040097509-A1 Diaryl compounds CCNL2, CCNI, CCNA1 SLC6A4 1969/4885SLC6A2 1307/4885SLC6A3 1978/4885
US-20050026920-A1 Selective serotonin re-uptake inhibitors; use in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder, post-traumatic stress disorder, substance abuse disorders and sexual dysfunction SLC6A4, SLC6A2, SLC6A3 SLC6A4 1/4885SLC6A2 2/4885SLC6A3 3/4885

“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.