SCHEMBL4408338

SCHEMBL4408338

CCCCc1nnnn1Cl

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
KCNH2 Q12809 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 2/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HPGD P15428 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
SCHEMBL4403901 0.94 ALDH1A1 (0.36) ALDH1A1LMNA
SCHEMBL4412155 0.92 CYP19A1 (0.36) ALDH1A1KCNH2LMNA
SCHEMBL4414869 0.87
SCHEMBL4671811 0.82 ALDH1A1 (0.31) ALDH1A1LMNANPSR1L3MBTL1
SCHEMBL4407247 0.77 ALDH1A1 (0.46) ALDH1A1LMNAHPGD
SCHEMBL4409185 0.75 ALDH1A1 (0.42) ALDH1A1LMNA
SCHEMBL8059095 0.75 ALDH1A1 (0.49) ALDH1A1KCNH2LMNAHPGD
SCHEMBL4407680 0.75 ALDH1A1 (0.41) ALDH1A1LMNAHPGD
SCHEMBL4409024 0.75 ALDH1A1 (0.41) ALDH1A1LMNAHPGD
SCHEMBL4408382 0.75 ALDH1A1 (0.38) 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-1859782-B1 Composition for coloring and/or lightening human hair comprising tetrazoles HENKEL AG & CO KGAA (DE) 2009-12-30 EP disclosed
EP-1859782-A1 Composition for coloring and/or lightening human hair comprising tetrazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed