SCHEMBL8533683

SCHEMBL8533683

COc1ccc2c(c1)C(C)CN2C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.44
SLC6A4 P31645 3/20 0.44
SLC6A3 Q01959 3/20 0.44
HTR2C P28335 2/20 0.43
HTR2A P28223 1/20 0.43
HTR2B P41595 1/20 0.43
LMNA P02545 1/20 0.42
OPRM1 P35372 1/20 0.41
MAPT P10636 1/20 0.41
SYK P43405 1/20 0.40
BRD4 O60885 1/20 0.40
SIGMAR1 Q99720 2/20 0.40
NISCH Q9Y2I1 1/20 0.39
CNR2 P34972 1/20 0.39
ACHE P22303 1/20 0.38

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
SCHEMBL18035005 0.81 TUBB4A (0.43) SLC6A2SLC6A4SLC6A3LMNAOPRM1
SCHEMBL16684889 0.79 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3HTR2CHTR2A
SCHEMBL5540524 0.77 SRD5A1 (0.43) SLC6A2SLC6A4SLC6A3HTR2CMAPT
SCHEMBL13437405 0.75 HTR2B (0.40) HTR2CHTR2AHTR2BLMNAOPRM1
SCHEMBL5539441 0.75 ESR1 (0.44) SLC6A2SLC6A4SLC6A3HTR2AOPRM1
SCHEMBL12363786 0.75 POLB (0.41) SLC6A2SLC6A4SLC6A3HTR2CHTR2A
SCHEMBL6073564 0.74 LMNA (0.55) HTR2CHTR2AHTR2BLMNAOPRM1
SCHEMBL68109 0.74 ACHE (0.51) LMNABRD4NISCHACHE
SCHEMBL13891861 0.74 NISCH (0.39) SLC6A2SLC6A4SLC6A3LMNAMAPT
SCHEMBL16494499 0.73 CACNA1G (0.52) SLC6A2SLC6A4SLC6A3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195954-A1 NOVEL COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-11 US disclosed
EP-0438796-B1 Process for the enantioselection synthesis of alkylated oxindoles used as intermediates in the preparation of physostigmine HOECHST MARION ROUSSEL INC (US) 1998-08-26 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 (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-20110195954-A1 NOVEL COMPOUNDS CALCRL, CALCR, CALCA SLC6A2 445/4885SLC6A4 282/4885SLC6A3 549/4885

“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.