SCHEMBL7088802

SCHEMBL7088802

CN1C2CCC1C(C(=O)O)C(c1ccccc1)C2

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.76
SLC6A2 P23975 5/20 0.76
SLC6A4 P31645 5/20 0.76

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
SCHEMBL15516162 1.00 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL7669406 1.00 SLC6A3 (0.76) SLC6A3SLC6A2SLC6A4
SCHEMBL7291113 0.92 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4
SCHEMBL7291105 0.92 SLC6A3 (0.65) SLC6A3SLC6A2SLC6A4
SCHEMBL9405548 0.90 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL9405547 0.90 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL9405598 0.90 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL6792848 0.89 SLC6A3 (0.72) SLC6A3SLC6A2SLC6A4
SCHEMBL7288922 0.89 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4
SCHEMBL7288917 0.89 SLC6A3 (0.74) SLC6A3SLC6A2SLC6A4

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-6660863-B2 Reacting an cycloheptatriene nitrile compound with nortropane compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2003-12-09 US disclosed
US-6596868-B2 Reacting a cycloheptatriene derivative with a primary amine or ammonia in the presence of a base NIHON MEDI-PHYSICS CO., LTD. (JP) 2003-07-22 US disclosed
US-20030109708-A1 Process for synthesizing anhydroecgonine derivative NIHON MEDI-PHYSICS CO., LTD. 2003-06-12 US disclosed
US-20010020096-A1 Process for synthesizing anhydroecgonine derivative NIHON MEDI-PHYSICS CO., LTD. (JP) 2001-09-06 US disclosed
EP-1127887-A1 Process for synthesizing anhydroecgonine derivative NIHON MEDI-PHYSICS Co., Ltd. (JP) 2001-08-29 EP 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-20030109708-A1 Process for synthesizing anhydroecgonine derivative CES2, NPR1, OPRL1 SLC6A3 385/4885SLC6A2 185/4885SLC6A4 908/4885
US-20010020096-A1 Process for synthesizing anhydroecgonine derivative CES2, NPR1, OPRL1 SLC6A3 385/4885SLC6A2 185/4885SLC6A4 908/4885

“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.