SCHEMBL9812944

SCHEMBL9812944

O=C1CCCCC(C(=O)c2cc(Cl)c(C(=O)C3CCCCC(=O)N3)cc2Cl)N1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
CRBN Q96SW2 1/20 0.33
SRD5A1 P18405 1/20 0.32
TSHR P16473 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
GAA P10253 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
SCHEMBL6251197 0.87 TSHR (0.41) ABL1SMN1; SMN2NPC1RAB9ASRD5A1
SCHEMBL6222119 0.82 ABL1 (0.38) ABL1TSHR
SCHEMBL7905841 0.82 SRD5A2 (0.37) ABL1SMN1; SMN2NPC1RAB9ASRD5A1
SCHEMBL7909007 0.82 LMNA (0.37) ABL1SMN1; SMN2NPC1RAB9ASRD5A1
SCHEMBL6224357 0.81 SLC6A2 (0.45) ABL1TSHR
SCHEMBL31032494 0.81 MCL1 (0.42) SMN1; SMN2HDAC3HDAC1HDAC2HDAC10
SCHEMBL7721046 0.80 ABL1 (0.38) ABL1SMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL9621802 0.79 ABL1 (0.34) ABL1SMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL8396673 0.78 ABL1 (0.36) ABL1SMN1; SMN2NPC1RAB9ASRD5A1
SCHEMBL11594493 0.78 MCL1 (0.35) ABL1SMN1; SMN2HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0113252-B1 PROCESS FOR PRODUCING BLOCK COPOLYAMIDE TORAY INDUSTRIES, INC. (JP) 1991-08-07 EP disclosed
US-4507465-A IMPACT STRENGTH TORAY INDUSTRIES, INC. (JP) 1985-03-26 US disclosed
EP-0113252-A2 Process for producing block copolyamide TORAY INDUSTRIES, INC. (JP) 1984-07-11 EP disclosed