SCHEMBL1037428

SCHEMBL1037428

Cc1cccn1-c1ccc[nH]1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL7195400 0.75 DAO (0.34)
SCHEMBL10370901 0.75 AURKA (0.34)
SCHEMBL1799123 0.72
SCHEMBL18631519 0.71 HMBS (0.40)
SCHEMBL28183364 0.71 CYP3A4 (0.47) ALDH1A1
SCHEMBL7195355 0.69 POLB (0.49)
SCHEMBL1707247 0.69 KDM4E (0.31) ALDH1A1
SCHEMBL1531054 0.67 KDM4E (0.32) ALDH1A1
SCHEMBL9217273 0.67 DAO (0.34) ALDH1A1
SCHEMBL12270200 0.66 KDM4E (0.32) ALDH1A1

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
EP-2276732-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-01-26 EP disclosed
WO-2009127686-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2009-10-22 WO disclosed