SCHEMBL2599496

SCHEMBL2599496

CC1NCCOC1c1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 1.00
SLC6A2 P23975 5/20 0.72
SLC6A3 Q01959 3/20 0.72
ADRA1A P35348 1/20 0.72
HTR2B P41595 1/20 0.72
PRCP P42785 1/20 0.38
HTR1A P08908 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HTR3A P46098 1/20 0.36
DRD2 P14416 1/20 0.36
SLC6A4 P31645 4/20 0.35

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
SCHEMBL2599484 0.84 SLC6A2 (0.74) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL15159760 0.84 SLC6A2 (1.00) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL33984 0.84 SLC6A2 (1.00) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL8094204 0.84 SLC6A2 (1.00) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL15154744 0.84 SLC6A2 (1.00) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL265002 0.84 SLC6A2 (1.00) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL15159761 0.84 SLC6A2 (1.00) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
SCHEMBL25273814 0.83 SLC6A2 (0.72) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
SCHEMBL2599478 0.83 SLC6A2 (0.72) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B
Phenmetrazine SCHEMBL121536 0.82 SLC6A2 (0.96) CHRNA7SLC6A2SLC6A3ADRA1AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130203752-A1 PHENYLMORPHOLINES AND ANALOGUES THEREOF NIH-DEITR 2013-08-08 US claimed
EP-2571858-B1 PHENYLMORPHOLINES AND ANALOGUES THEREOF RES TRIANGLE INST (US) 2018-06-20 EP disclosed
US-9617229-B2 Phenylmorpholines and analogues thereof RESEARCH TRIANGLE INSTITUTE (US) 2017-04-11 US disclosed
US-20130203752-A1 PHENYLMORPHOLINES AND ANALOGUES THEREOF NIH-DEITR 2013-08-08 US disclosed
EP-2571858-A1 PHENYLMORPHOLINES AND ANALOGUES THEREOF Research Triangle Institute (US) 2013-03-27 EP disclosed
WO-2011146850-A1 PHENYLMORPHOLINES AND ANALOGUES THEREOF RESEARCH TRIANGLE INSTITUTE (US) 2011-11-24 WO 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-20130203752-A1 PHENYLMORPHOLINES AND ANALOGUES THEREOF PNMT, OPRL1, OPRM1 CHRNA7 134/4885SLC6A2 5/4885SLC6A3 8/4885

“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.