SCHEMBL3789134

SCHEMBL3789134

Fc1cccc(CO[C@H]2C[C@H]3CC[C@@H](C2)N3)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.58
SLC6A4 P31645 7/20 0.58
SLC6A3 Q01959 7/20 0.58
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
PRMT8 Q9NR22 1/20 0.50
IDO1 P14902 2/20 0.46
AGXT P21549 2/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
SIGMAR1 Q99720 3/20 0.45
TMEM97 Q5BJF2 1/20 0.44
KCNH2 Q12809 1/20 0.43
DRD4 P21917 3/20 0.42
TACR1 P25103 1/20 0.42

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
SCHEMBL3789138 1.00 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3CARM1PRMT6
Hydrochloric Acid SCHEMBL3519861 0.99 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3CARM1PRMT6
Hydrochloric Acid SCHEMBL3519857 0.99 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3CARM1PRMT6
SCHEMBL12012233 0.85 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3DRD2DRD3
Hydrochloric Acid SCHEMBL3521583 0.84 SLC6A4 (0.43) SLC6A2SLC6A4SLC6A3DRD2DRD3
Hydrochloric Acid SCHEMBL3521586 0.84 SLC6A4 (0.43) SLC6A2SLC6A4SLC6A3DRD2DRD3
SCHEMBL12012208 0.82 SLC6A4 (0.58) SLC6A2SLC6A4SLC6A3IDO1TACR1
SCHEMBL3520414 0.81 DRD2 (0.57) SLC6A2SLC6A4SLC6A3CARM1PRMT6
SCHEMBL3520412 0.81 DRD2 (0.57) SLC6A2SLC6A4SLC6A3CARM1PRMT6
Hydrochloric Acid SCHEMBL3524589 0.81 SLC6A4 (0.57) SLC6A2SLC6A4SLC6A3IDO1TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252810-B2 Bicycloamine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-08-28 US disclosed
US-20100331310-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-30 US disclosed
US-20090270369-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-10-29 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-20100331310-A1 BICYCLOAMINE DERIVATIVES SCN1B, KCNJ2, KCNH2 SLC6A2 333/4885SLC6A4 416/4885SLC6A3 499/4885
US-20090270369-A1 BICYCLOAMINE DERIVATIVES SCN1B, KCNJ2, KCNH2 SLC6A2 333/4885SLC6A4 416/4885SLC6A3 499/4885

“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.