SCHEMBL5847232

SCHEMBL5847232

O=C(Nc1ccccc1)Nc1csnn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.57
TP53 P04637 2/20 0.57
EPHX1 P07099 1/20 0.57
TSHR P16473 1/20 0.57
EPHX2 P34913 1/20 0.57
CDK9 P50750 1/20 0.57
CLK4 Q9HAZ1 1/20 0.57
ALDH1A1 P00352 4/20 0.56
ATM Q13315 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
NPC1 O15118 6/20 0.54
RAB9A P51151 6/20 0.54
ADORA3 P0DMS8 2/20 0.54
PIM1 P11309 2/20 0.54
ADORA2A P29274 1/20 0.54
ADORA2B P29275 1/20 0.54
ADORA1 P30542 1/20 0.54
FLT3 P36888 1/20 0.54
PIM3 Q86V86 1/20 0.54
AURKB Q96GD4 1/20 0.54

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
SCHEMBL9666195 0.78 ALDH1A1 (0.67) SMN1; SMN2TP53ALDH1A1ATML3MBTL1
SCHEMBL8374464 0.78 KMT2A (0.68) SMN1; SMN2ALDH1A1NPC1RAB9AKMT2A
SCHEMBL27563910 0.76 RAB9A (0.60) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL11168362 0.76
SCHEMBL2859096 0.76 LMNA (0.73) SMN1; SMN2TP53TSHRALDH1A1ATM
Diphenylurea SCHEMBL133103 0.75 SMN1; SMN2 (1.00) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL11093808 0.75 ALDH1A1 (0.58) SMN1; SMN2TP53ALDH1A1ATML3MBTL1
SCHEMBL2840428 0.74 KMT2A (0.48) SMN1; SMN2TP53TSHRALDH1A1ATM
Diphenylurea SCHEMBL3037927 0.73 SMN1; SMN2 (0.94) SMN1; SMN2TP53EPHX1TSHREPHX2
Diphenylurea SCHEMBL28431956 0.73 SMN1; SMN2 (0.94) SMN1; SMN2TP53EPHX1TSHREPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7005298-B1 Micropropagation and production of phytopharmaceutical plants UNIVERSITY OF GUELPH (CA) 2006-02-28 US claimed
EP-1164831-B1 MICROPROPAGATION AND PRODUCTION OF PHYTOPHARMACEUTICAL PLANTS UNIV GUELPH (CA) 2003-11-05 EP claimed
EP-1164831-A2 MICROPROPAGATION AND PRODUCTION OF PHYTOPHARMACEUTICAL PLANTS University of Guelph (CA) 2002-01-02 EP claimed
WO-2000057690-A2 MICROPROPAGATION AND PRODUCTION OF PHYTOPHARMACEUTICAL PLANTS UNIVERSITY OF GUELPH (CA) 2000-10-05 WO claimed
WO-2019006466-A1 COMPOSITIONS AND METHODS FOR LARGE-SCALE IN VITRO PLANT BIOCULTURE BOOSHOOT LLC (US) 2019-01-03 WO disclosed
US-7005298-B1 Micropropagation and production of phytopharmaceutical plants UNIVERSITY OF GUELPH (CA) 2006-02-28 US disclosed
EP-1164831-B1 MICROPROPAGATION AND PRODUCTION OF PHYTOPHARMACEUTICAL PLANTS UNIV GUELPH (CA) 2003-11-05 EP disclosed
US-4472188-A 1-PHENYL-3-(1,2,3-THIADIAZOL-5-YL)UREA AND O,O-DIMETHYL (OR DIETHYL)-O-P-NITROPHENYL-THIOPHOSPHORIC ACID ESTER SCHERING AKTIENGESELLSCHAFT (DE) 1984-09-18 US disclosed