SCHEMBL8554355

SCHEMBL8554355

Cc1nc(NC(C)(C)C)sc1C(=O)Cl

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.43
DHODH Q02127 1/20 0.41
RXFP1 Q9HBX9 3/20 0.41
CYP1A2 P05177 1/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 8/20 0.40
LCK P06239 3/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL8554826 0.84 ALDH1A1 (0.50) PIK3CGDHODHRXFP1CYP1A2GAA
Hydrochloric Acid SCHEMBL8554359 0.83 ALDH1A1 (0.49) PIK3CGDHODHRXFP1CYP1A2GAA
SCHEMBL10110823 0.83 GFER (0.49) PIK3CGDHODHRXFP1CYP1A2GAA
SCHEMBL8556702 0.76 MAPK14 (0.48) RXFP1NPC1RAB9AKDM4EMEN1
SCHEMBL8557699 0.75 LCK (0.58) RXFP1CYP1A2GAACYP2C9MEN1
SCHEMBL4172293 0.74 ALDH1A1 (0.52) PIK3CGNPC1RAB9AKDM4EMEN1
SCHEMBL1539903 0.74 LCK (0.43) DHODHRXFP1CYP1A2GAACYP2C9
SCHEMBL8551752 0.73 LMNA (0.44) RXFP1CYP1A2GAACYP2C9NPC1
SCHEMBL3344131 0.71 CNR1 (0.47) GAANPC1RAB9AALDH1A1L3MBTL1
SCHEMBL5159455 0.70 ALDH1A1 (0.36) PIK3CGDHODHRXFP1NPC1RAB9A

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-0639574-B1 2-aminothiazolecarboxamide derivatives, processes for their preparation and their use for controlling phytopathogenic organisms LUCKY LTD (KR) 1998-06-10 EP disclosed
US-5514643-A FUNGICIDES FOR PLANTS LUCKY LTD. (KR) 1996-05-07 US disclosed
EP-0639574-A1 2-aminothiazolecarboxamide derivatives, processes for their preparation and their use for controlling phytopathogenic organisms LUCKY LTD. (KR) 1995-02-22 EP disclosed