SCHEMBL4137440

SCHEMBL4137440

Cc1ccc(-c2ccccc2CO[C@H]2CCNC2)cc1C

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.47
SLC6A4 P31645 6/20 0.47
SLC6A3 Q01959 6/20 0.47
KCNH2 Q12809 4/20 0.47
HTR7 P34969 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
CYP2D6 P10635 2/20 0.39
CHRM3 P20309 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
SCHEMBL4137447 1.00 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3KCNH2HTR7
SCHEMBL4124153 0.90 KCNH2 (0.44) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2
SCHEMBL4124159 0.90 KCNH2 (0.44) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2
SCHEMBL4136235 0.89 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL4136227 0.89 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL4125219 0.86 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2
SCHEMBL4125212 0.86 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2
SCHEMBL4131951 0.85 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2
SCHEMBL4131943 0.85 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2
Hydrochloric Acid SCHEMBL4124139 0.85 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3KCNH2CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215857-A1 Therapeutic Pyrrolidines PFIZER PRODUCTS INC. (US) 2009-08-27 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-20090215857-A1 Therapeutic Pyrrolidines OPRL1, HTR5A, OPRD1 SLC6A2 28/4885SLC6A4 18/4885SLC6A3 19/4885

“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.