SCHEMBL18985196

SCHEMBL18985196

CC(=O)Nc1cccc(NC(=O)/C=C/c2ccc(Cl)s2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.54
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
MAPT P10636 6/20 0.54
SMN1; SMN2 Q16637 6/20 0.54
NPC1 O15118 4/20 0.54
MITF O75030 1/20 0.54
HTT P42858 1/20 0.54
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.52
ALDH1A1 P00352 2/20 0.47
ATM Q13315 1/20 0.47
MAOB P27338 5/20 0.47
MMP1 P03956 4/20 0.47
MMP2 P08253 4/20 0.47
MMP9 P14780 4/20 0.47
MAOA P21397 3/20 0.47
EGFR P00533 2/20 0.47
POLB P06746 1/20 0.47
NR4A1 P22736 1/20 0.47

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
SCHEMBL19003232 0.83 RAB9A (0.53) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL19003263 0.82 SMN1; SMN2 (0.41) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL19003240 0.80 MAPT (0.57) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL19003245 0.76 BCHE (0.58) MEN1KMT2AMAPTSMN1; SMN2HTT
SCHEMBL3590876 0.75 MMP1 (0.74) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL3590874 0.75 MMP1 (0.74) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL18985528 0.74 NQO2 (0.56) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL19003466 0.74 NQO2 (0.56) RAB9AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL19003241 0.74 TGM2 (0.52) RAB9AMEN1KMT2AMAPTNPC1
SCHEMBL19003251 0.74 EGFR (0.68) RAB9AMEN1KMT2AMAPTSMN1; SMN2

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
WO-2017102014-A1 PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE UNIVERSITE D'AIX-MARSEILLE (FR) 2017-06-22 WO claimed
WO-2017102014-A1 PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE UNIVERSITE D'AIX-MARSEILLE (FR) 2017-06-22 WO disclosed