SCHEMBL5998401

SCHEMBL5998401

C=CCCCC(O)(C(C)=O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
ABCC4 O15439 1/20 0.42
ALDH1A1 P00352 5/20 0.37
LMNA P02545 2/20 0.37
TSHR P16473 2/20 0.36
ACLY P53396 1/20 0.34
USP2 O75604 2/20 0.33
CYP3A4 P08684 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RECQL P46063 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 1/20 0.31

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
SCHEMBL5998393 1.00 MAPT (0.42) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL2179945 0.78 ALDH1A1 (0.38) MAPTALDH1A1TSHR
SCHEMBL29039008 0.78 ALDH1A1 (0.38) MAPTALDH1A1TSHR
SCHEMBL28648606 0.78 ALDH1A1 (0.38) MAPTALDH1A1TSHR
SCHEMBL3041677 0.76 ABCC4 (0.46) MAPTABCC4ALDH1A1LMNATSHR
Acetic Acid SCHEMBL27565407 0.74 MAPT (0.61) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL4904722 0.74 MAPT (0.45) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL1697837 0.74 ACLY (0.41) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL2894770 0.74 ACLY (0.61) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL3968169 0.74 ABCC4 (0.45) MAPTABCC4ALDH1A1LMNATSHR

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-7038043-B1 Glycosylated indolocarbazole synthesis YALE UNIVERSITY (US) 2006-05-02 US disclosed
WO-1997007081-A2 GLYCOSYLATED INDOLOCARBAZOLE SYNTHESIS YALE UNIVERSITY (US) 1997-02-27 WO disclosed