SCHEMBL4413433

SCHEMBL4413433

FC(F)(F)C(F)(F)c1nnnn1Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
P2RX7 Q99572 5/20 0.48
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.43
SLC9A1 P19634 1/20 0.42
GRM2 Q14416 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
IDO1 P14902 1/20 0.41
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL4405417 0.87 LMNA (0.53) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL4409103 0.81 LMNA (0.54) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL4414765 0.80 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL4405642 0.79 LMNA (0.51) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL994214 0.74 LMNA (0.57) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL38655895 0.72 LMNA (0.51) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL4405081 0.72 ALDH1A1 (0.41) LMNAALDH1A1KMT2ATSHR
SCHEMBL2163180 0.72 LMNA (0.59) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL4408444 0.72 LMNA (0.59) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL4405847 0.71 ALDH1A1 (0.64) LMNAALDH1A1KMT2AMEN1TSHR

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