SCHEMBL9768557

SCHEMBL9768557

C=CC(=O)NCCNC(=O)CCS(=O)(=O)CCCl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAPK1 P28482 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
KMT2A Q03164 4/20 0.34
POLB P06746 2/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
FAAH O00519 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2C19 P33261 1/20 0.31
PYGL P06737 1/20 0.31
APEX1 P27695 1/20 0.31
MAPT P10636 2/20 0.30
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
CNR1 P21554 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
SCHEMBL5383751 0.88 TSHR (0.50) ALDH1A1TSHRTDP1MAPK1ZDHHC20
SCHEMBL11596131 0.81 FAAH (0.36) ALDH1A1TSHRTDP1KMT2APOLB
SCHEMBL11591963 0.79 KMT2A (0.33) KMT2APOLBMEN1HTTRXFP1
SCHEMBL11595202 0.79 FAAH (0.36) ALDH1A1TSHRTDP1KMT2APOLB
SCHEMBL11133899 0.79 TSHR (0.41) ALDH1A1TSHRTDP1MAPK1ZDHHC20
SCHEMBL11595057 0.77 KMT2A (0.32) KMT2APOLBMEN1HTTRXFP1
SCHEMBL10902933 0.75 TSHR (0.52) ALDH1A1TSHRTDP1MAPK1ZDHHC20
SCHEMBL11759922 0.75 ALDH1A1 (0.52) ALDH1A1TSHRTDP1MAPK1ZDHHC20
SCHEMBL10396765 0.73 ALDH1A1 (0.52) ALDH1A1TSHRTDP1MAPK1ZDHHC20
SCHEMBL14593602 0.73 FAAH (0.42) ALDH1A1TSHRKMT2APOLBMEN1

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-5057407-A Vinyl polymer particles having group reactive with organic hardener or binder, matling agent FUJI PHOTO FILM CO., LTD. (JP) 1991-10-15 US disclosed