SCHEMBL11570952

SCHEMBL11570952

ClCCNN(CCCl)CCCl

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
MAPT P10636 1/20 0.33
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
ABCB11 O95342 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GSR P00390 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
KMT2A Q03164 1/20 0.32
TP53 P04637 1/20 0.32
HBB P68871 1/20 0.32

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
SCHEMBL10379658 0.73 MAPT (0.38) LMNAMAPTTSHRHTTMEN1
SCHEMBL11272684 0.65
SCHEMBL7737717 0.61
Nornitrogen Mustard SCHEMBL24674 0.55
Trichlormethine SCHEMBL8224 0.55 LMNA (0.91) LMNAMAPTTSHRHTTMEN1
SCHEMBL8514969 0.55
Nornitrogen Mustard SCHEMBL2064862 0.53
Trichlormethine SCHEMBL1820371 0.53 LMNA (0.83) LMNAMAPTTSHRHTTMEN1
SCHEMBL5385190 0.53
SCHEMBL722930 0.53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0005380-A2 Phototropic photosensitive compositions containing a fluoran colorformer Dynachem Corporation (US) 1979-11-14 EP disclosed