SCHEMBL6891427

SCHEMBL6891427

CCCCCCC(C)Nc1cccc(Nc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MAPT P10636 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
AR P10275 1/20 0.47
HSD17B10 Q99714 3/20 0.46
MAPK1 P28482 3/20 0.46
CYP3A4 P08684 3/20 0.46
TSHR P16473 3/20 0.46
ALOX15 P16050 2/20 0.46
ALOX12 P18054 2/20 0.46
HIF1A Q16665 1/20 0.46
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
KCNH3 Q9ULD8 3/20 0.42
HDAC1 Q13547 2/20 0.41
LMNA P02545 2/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL29947700 0.93 ALDH1A1 (0.47) ALDH1A1MAPTKMT2AMEN1AR
SCHEMBL1123435 0.91 ADH1B (0.42) ALDH1A1MAPTHSD17B10CYP3A4TSHR
SCHEMBL11353374 0.89 ALDH1A1 (0.58) ALDH1A1MAPTKMT2AMEN1HSD17B10
SCHEMBL809566 0.89 ALDH1A1 (0.58) ALDH1A1MAPTKMT2AMEN1HSD17B10
SCHEMBL809646 0.89 ALDH1A1 (0.58) ALDH1A1MAPTKMT2AMEN1HSD17B10
SCHEMBL38948 0.89 ALDH1A1 (0.58) ALDH1A1MAPTKMT2AMEN1HSD17B10
SCHEMBL1662136 0.88 ALDH1A1 (0.60) ALDH1A1MAPTKMT2AMEN1HSD17B10
SCHEMBL1454054 0.86 ALDH1A1 (0.47) ALDH1A1HSD17B10MAPK1CYP3A4TSHR
SCHEMBL9011314 0.86 ALDH1A1 (0.47) ALDH1A1HSD17B10MAPK1CYP3A4TSHR
SCHEMBL22646172 0.86 ALDH1A1 (0.47) ALDH1A1HSD17B10MAPK1CYP3A4TSHR

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-20040156933-A1 Polymer additives with improved permanence and surface affinity CIBA SPECIALTY CHEMICALS CORP. 2004-08-12 US disclosed
US-6573316-B1 Stabilizer selected from the group consisting of phenols, amines, phosphites, thioethers, and thioacids; obtained by adding stabilizer liquid or solution to the aqueous polymer solution prior to conversion into powder SKW BAUCHEMIE GMBH (DE) 2003-06-03 US disclosed