SCHEMBL8733205

SCHEMBL8733205

C[C]c1cccc(CCl)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
GLA P06280 1/20 0.35
TTR P02766 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.32
PNMT P11086 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP19A1 P11511 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL5158276 0.78 TSHR (0.46) TSHRGLAMRGPRX4PNMTMEN1
SCHEMBL18405 0.78 GLA (0.50) TSHRGLAMRGPRX4CYP19A1CYP11B1
SCHEMBL29386535 0.78 GLA (0.50) TSHRGLAMRGPRX4CYP19A1CYP11B1
SCHEMBL2186054 0.75 ACHE (0.42) TSHR
SCHEMBL225197 0.75 TSHR (0.54) TSHRTTRPNMTMEN1KMT2A
SCHEMBL8733187 0.70
SCHEMBL3338130 0.70
SCHEMBL8733207 0.70 TP53 (0.48) TSHR
SCHEMBL30084583 0.70
SCHEMBL52147 0.70

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
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 WO disclosed
US-5422360-A Hydrazonoimidazolidin-4-one derivatives; treatment of diabetes and aging disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-06-06 US disclosed
EP-0531812-A1 Maillard reaction inhibitor, process for producing it, composition containing it and the use thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-03-17 EP disclosed