SCHEMBL3622684

SCHEMBL3622684

Sc1cccc2c(-c3ccccc3)ccnc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 3/20 0.56
COPS5 Q92905 3/20 0.56
IKBKB O14920 1/20 0.45
CHUK O15111 1/20 0.45
DAPK3 O43293 1/20 0.45
JAK2 O60674 1/20 0.45
PRKD3 O94806 1/20 0.45
MAP4K4 O95819 1/20 0.45
PAK4 O96013 1/20 0.45
CSF1R P07333 1/20 0.45
RET P07949 1/20 0.45
IGF1R P08069 1/20 0.45
FGFR1 P11362 1/20 0.45
PRKACA P17612 1/20 0.45
FLT1 P17948 1/20 0.45
LTK P29376 1/20 0.45
GRK5 P34947 1/20 0.45
KDR P35968 1/20 0.45
MAP2K2 P36507 1/20 0.45
MAPK8 P45983 1/20 0.45

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
SCHEMBL8035529 0.86 PSMD14 (0.56) PSMD14COPS5CKS1BSKP2GLO1
SCHEMBL2639313 0.81 PLG (0.49) IKBKBCHUKDAPK3JAK2PRKD3
SCHEMBL28868 0.81 IKBKB (0.53) IKBKBCHUKDAPK3JAK2PRKD3
Benzene SCHEMBL28095234 0.81 IKBKB (0.53) IKBKBCHUKDAPK3JAK2PRKD3
SCHEMBL28859500 0.81 IKBKB (0.53) IKBKBCHUKDAPK3JAK2PRKD3
Ammonia Solution, Strong SCHEMBL17396339 0.79 IKBKB (0.52) IKBKBCHUKDAPK3JAK2PRKD3
Hydrochloric Acid SCHEMBL17396321 0.79 IKBKB (0.52) IKBKBCHUKDAPK3JAK2PRKD3
Hydrochloric Acid SCHEMBL1238416 0.79 IKBKB (0.52) IKBKBCHUKDAPK3JAK2PRKD3
SCHEMBL9448814 0.79 IKBKB (0.52) IKBKBCHUKDAPK3JAK2PRKD3
Hydrochloric Acid SCHEMBL21643628 0.79 IKBKB (0.52) IKBKBCHUKDAPK3JAK2PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144512-B2 Method of reclaiming brine solutions using an organic chelant BJ SERVICES COMPANY (US) 2006-12-05 US claimed
US-20050014654-A1 Method of reclaiming brine solutions using an organic chelant BAKER HUGHES HOLDINGS LLC 2005-01-20 US claimed
US-7674384-B2 Method of reclaiming brine solutions using an organic chelant BJ SERVICES COMPANY (US) 2010-03-09 US disclosed
US-20070131623-A1 Method of reclaiming brine solutions using an organic chelant BJ SERVICES COMPANY 2007-06-14 US disclosed
US-20070095762-A1 Method of reclaiming brine solutions using an organic chelant BAKER HUGHES, A GE COMPANY, LLC 2007-05-03 US disclosed
US-7144512-B2 Method of reclaiming brine solutions using an organic chelant BJ SERVICES COMPANY (US) 2006-12-05 US disclosed
US-20050014654-A1 Method of reclaiming brine solutions using an organic chelant BAKER HUGHES HOLDINGS LLC 2005-01-20 US disclosed