SCHEMBL2849136

SCHEMBL2849136

CN(C(=O)OC(C)(C)C)[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccc(I)cc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.59
SLC6A2 P23975 11/20 0.59
SLC6A3 Q01959 11/20 0.59
QSOX1 O00391 1/20 0.43

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
SCHEMBL6248745 0.96 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6248740 0.96 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6248737 0.96 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6250983 0.90 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6250976 0.90 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6250980 0.90 SLC6A4 (0.53) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6247848 0.89 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6247849 0.89 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL6247852 0.89 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3QSOX1
SCHEMBL3363477 0.88 SLC6A4 (0.58) SLC6A4SLC6A2SLC6A3QSOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100279990-A1 ANTIPROLIFERATIVE COMPOUNDS, COMPOSITIONS AND METHODS OF USE RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2010-11-04 US disclosed
US-20100130549-A1 PSYCHOTROPIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2010-05-27 US disclosed
EP-2029517-A2 ANTIPROLIFERATIVE COMPOUNDS, COMPOSITIONS AND METHODS OF USE Ramot at Tel-Aviv University Ltd. (IL) 2009-03-04 EP disclosed
WO-2007146796-A2 ANTIPROLIFERATIVE COMPOUNDS, COMPOSITIONS AND METHODS OF USE RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2007-12-21 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 (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-20100279990-A1 ANTIPROLIFERATIVE COMPOUNDS, COMPOSITIONS AND METHODS OF USE STRA6, GPR6, CCNO SLC6A4 326/4885SLC6A2 102/4885SLC6A3 118/4885
US-20100130549-A1 PSYCHOTROPIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE SLC6A2, CHRNA6, SLC6A3 SLC6A4 7/4885SLC6A2 1/4885SLC6A3 3/4885

“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.