SCHEMBL9490800

SCHEMBL9490800

CCc1cccc(C(=O)NCCCCCCCCNC(=O)c2cccc(CC)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
NAAA Q02083 1/20 0.59
LMNA P02545 1/20 0.57
SMYD3 Q9H7B4 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.54
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
TP53BP1 Q12888 1/20 0.52
TMEM97 Q5BJF2 2/20 0.52
SIGMAR1 Q99720 2/20 0.52
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51

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
SCHEMBL16248158 0.89 L3MBTL1 (0.69) HDAC3SMN1; SMN2NAAALMNASMYD3
SCHEMBL15676736 0.88 NPC1 (0.72) HDAC3SMN1; SMN2NPC1RAB9AHDAC4
SCHEMBL12228078 0.87 SMN1; SMN2 (0.57) HDAC3SMN1; SMN2SMYD3L3MBTL1NPC1
SCHEMBL12055875 0.87 SIGMAR1 (0.59) HDAC3SMN1; SMN2SMYD3TMEM97SIGMAR1
SCHEMBL24527070 0.86 HDAC3 (0.58) HDAC3SMN1; SMN2SMYD3L3MBTL1NPC1
SCHEMBL24904322 0.86 SMN1; SMN2 (0.55) HDAC3SMN1; SMN2SMYD3L3MBTL1NPC1
SCHEMBL15601826 0.85 KAT6A (0.53) HDAC3SMN1; SMN2SMYD3L3MBTL1NPC1
SCHEMBL9691071 0.85 KAT6A (0.55) HDAC3SMN1; SMN2SMYD3L3MBTL1NPC1
SCHEMBL3195633 0.84 LMNA (0.55) HDAC3SMN1; SMN2LMNASMYD3L3MBTL1
SCHEMBL2056391 0.84 HPGD (0.57) HDAC3SMN1; SMN2SMYD3L3MBTL1NPC1

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
US-5191003-A Diamide compound, improved tire gripping, vibration insulation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-02 US disclosed
EP-0470776-A1 Rubber composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-02-12 EP disclosed