SCHEMBL8945147

SCHEMBL8945147

Cc1cc(Cc2ccccc2C2(C)CCCCC2)ccc1N

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.38
HDAC4 P56524 2/20 0.38
TSHR P16473 3/20 0.34
GLA P06280 1/20 0.34
ALOX12 P18054 1/20 0.34
FFAR1 O14842 1/20 0.33
RXRA P19793 2/20 0.33
CYP3A4 P08684 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
P2RX7 Q99572 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LTA4H P09960 1/20 0.32
SLC6A4 P31645 1/20 0.31
HSD11B1 P28845 1/20 0.31
HSD11B2 P80365 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
SCHEMBL8945132 0.86 SKP2 (0.38) SKP2HDAC4FFAR1RXRASLC6A4
SCHEMBL8945164 0.85 HDAC4 (0.41) HDAC4TSHRGLAALOX12FFAR1
SCHEMBL8945419 0.85 RXRA (0.37) HDAC4TSHRGLAALOX12RXRA
SCHEMBL8945516 0.84 SKP2 (0.40) SKP2HDAC4FFAR1RXRASLC6A4
SCHEMBL8944994 0.83 HDAC4 (0.34) SKP2HDAC4RXRACYP3A4
SCHEMBL8468338 0.83 ALDH1A1 (0.38) HDAC4TSHRFFAR1CYP3A4TDP1
SCHEMBL8945489 0.82 SKP2 (0.44) SKP2HDAC4FFAR1SLC6A4
SCHEMBL8945342 0.81 SKP2 (0.43) SKP2HDAC4FFAR1SLC6A4
SCHEMBL8945573 0.80 SKP2 (0.42) SKP2HDAC4FFAR1SLC6A4
SCHEMBL8944988 0.80 SKP2 (0.42) SKP2HDAC4FFAR1SLC6A4

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
US-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed