SCHEMBL7652118

SCHEMBL7652118

[CH2]CC1CCCCC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
IDO1 P14902 1/20 0.30
TDO2 P48775 1/20 0.30

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
SCHEMBL4578585 0.93
SCHEMBL6557170 0.78 GAA (0.32) GAAIDO1TDO2
SCHEMBL15541917 0.76 GAA (0.31) GAAIDO1TDO2
SCHEMBL20548668 0.76 GAA (0.31) GAAIDO1TDO2
SCHEMBL14248183 0.76 UGT2B7 (0.38) GAAIDO1TDO2
SCHEMBL15540957 0.76 GAA (0.31) GAAIDO1TDO2
SCHEMBL3538317 0.76 GAA (0.31) GAAIDO1TDO2
Hydrochloric Acid SCHEMBL16874317 0.74 GAA (0.31) GAA
SCHEMBL16910773 0.73
SCHEMBL17180640 0.73 CYP1A2 (0.32)

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
CN-1149214-C Triazolo gerivatives and chemokine inhibitors containing the same as the active ingredient ������������ʽ���� 2004-05-12 CN disclosed
US-6492364-B1 Triazolo and derivatives as chemokine inhibitors TORAY INDUSTRIES, INC. (JP) 2002-12-10 US disclosed
WO-2002062340-A1 HIGHLY LIPOPHILIC CAMPTOTHECIN PRODRUGS, METHODS OF PREPARATION, AND FORMULATIONS THEREOF UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2002-08-15 WO disclosed
CN-1293674-A Triazolo gerivatives and chemokine inhibitors containing the same as the active ingredient TORAY INDUSTRIES (JP) 2001-05-02 CN disclosed
EP-1067130-A1 TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2001-01-10 EP disclosed