SCHEMBL8301388

SCHEMBL8301388

O=C(NCc1ccc2c(c1)CCO2)c1cc(Cl)ccc1NC(=O)N1CCC(C(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.48
GAA P10253 1/20 0.48
FAAH O00519 1/20 0.45
RAB9A P51151 2/20 0.45
EPHX2 P34913 1/20 0.45
NPC1 O15118 1/20 0.45
F10 P00742 2/20 0.43
MCHR1 Q99705 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
THRB P10828 1/20 0.41
RYR2 Q92736 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL8300888 0.87 POLB (0.64) POLBGAAEPHX2MCHR1MAPT
SCHEMBL8299249 0.78 POLB (0.61) POLBGAAMCHR1MAPTKDM4E
SCHEMBL8436830 0.77 GAA (0.54) POLBGAAKDM4EALDH1A1PDE4A
SCHEMBL8297193 0.76 POLB (0.58) POLBGAARAB9ANPC1F10
SCHEMBL8297238 0.74 POLB (0.53) POLBGAAMCHR1MAPTKDM4E
SCHEMBL9225103 0.74 EPHX2 (0.55) RAB9AEPHX2F10MAPTKDM4E
SCHEMBL8414604 0.73 LMNA (0.46) POLBGAAMAPTLMNA
SCHEMBL17241507 0.73 RAB9A (0.55) POLBRAB9ANPC1MAPTKDM4E
SCHEMBL8293460 0.72 MAPT (0.52) POLBGAAMAPTLMNAMAPK1
SCHEMBL8570087 0.72 GAA (0.57) POLBGAAMCHR1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686625-B1 ANTHRANILIC ACID DERIVATIVE EISAI CO LTD (JP) 1999-05-26 EP disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP disclosed