SCHEMBL8712306

SCHEMBL8712306

Cc1sccc1C1C(=O)NC(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BRPF1 P55201 1/20 0.30
CREBBP Q92793 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
SCHEMBL8086673 0.78 ALDH1A1 (0.43) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL812403 0.65 SMN1; SMN2 (0.43) ALDH1A1KMT2APOLBKDM4EHPGD
SCHEMBL4433341 0.63 GAA (0.40) ALDH1A1MEN1KMT2APOLBKDM4E
SCHEMBL5771881 0.62 MAPT (0.33) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL14612064 0.62
SCHEMBL6207998 0.61 ALDH1A1 (0.49) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL12213145 0.61
SCHEMBL10045608 0.60
SCHEMBL16592250 0.59 PARP15 (0.30)
SCHEMBL13475987 0.58

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-5807805-A Substituted thiophene derivatives as pesticides and herbicides BAYER AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed