SCHEMBL8437855

SCHEMBL8437855

[CH2]CC(=O)NCC(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
USP2 O75604 1/20 0.33
CA2 P00918 2/20 0.31
GLA P06280 1/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL11276095 0.85 TSHR (0.52) TSHRCA2GLAHTTL3MBTL1
SCHEMBL17624747 0.81 KMT2A (0.48) TSHRUSP2GLAHTTL3MBTL1
SCHEMBL6389655 0.80 FAAH (0.36) TSHRUSP2CYP2D6CYP2C19
SCHEMBL17122532 0.79 TSHR (0.34) TSHRUSP2GLAHTTL3MBTL1
SCHEMBL27265349 0.77 SMN1; SMN2 (0.44) TSHRUSP2GLAHTTL3MBTL1
SCHEMBL22134300 0.77 CASP2 (0.47) TSHRL3MBTL1CYP2C19
SCHEMBL8183822 0.76
SCHEMBL8436255 0.76 TSHR (0.36) TSHRUSP2GLAHTTL3MBTL1
SCHEMBL14586419 0.74 TSHR (0.34) TSHRUSP2GLAHTTL3MBTL1
SCHEMBL20220900 0.74 TLR2 (0.45) TSHRGLAHTTL3MBTL1KMT2A

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-0777658-B1 SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS BASF AG (DE) 1999-12-15 EP disclosed
US-5885934-A HERBICIDES OR FOR THE DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed