SCHEMBL8563210

SCHEMBL8563210

CC(=O)OCC(=O)Nc1ccc(Cl)c(C)c1Cl

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.63
HPGD P15428 1/20 0.63
SMN1; SMN2 Q16637 4/20 0.56
MAPT P10636 2/20 0.49
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 1/20 0.49
NPSR1 Q6W5P4 1/20 0.45
PKM P14618 1/20 0.45
POLB P06746 2/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL8558945 0.77 ALDH1A1 (0.47) HPGDMAPTALDH1A1HSD17B10POLB
SCHEMBL8560680 0.75 KDM4E (0.50) SMN1; SMN2ALDH1A1LMNAKDM4EMEN1
SCHEMBL31663015 0.72 SMN1; SMN2 (0.58) USP2HPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL28756536 0.72 SMN1; SMN2 (1.00) HPGDSMN1; SMN2MAPTALDH1A1HSD17B10
SCHEMBL6838324 0.72 SMN1; SMN2 (0.66) USP2HPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL15179293 0.71 SMN1; SMN2 (0.54) USP2HPGDSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL31663198 0.70 SMN1; SMN2 (0.56) USP2HPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL31663234 0.70 HPGD (0.71) USP2HPGDSMN1; SMN2MAPTALDH1A1
Acreozast SCHEMBL6454819 0.70 GPR35 (0.59) USP2HPGDSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL8568419 0.70 KMT2A (0.41) USP2HPGDALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed