SCHEMBL9345812

SCHEMBL9345812

Clc1cccc2cnoc12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2A6 P11509 2/20 0.38
PSMB8 P28062 2/20 0.38
PSMB5 P28074 1/20 0.38
AHR P35869 4/20 0.38
MAPK14 Q16539 1/20 0.35
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TDO2 P48775 1/20 0.33
PRMT5 O14744 1/20 0.32

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
SCHEMBL6968338 0.78 CYP3A4 (0.39) CYP1A2PSMB8MAPK14TSHRCYP3A4
SCHEMBL10367732 0.74 KDM4E (0.39) CYP1A2MAPK14TSHRCYP3A4LMNA
SCHEMBL5535329 0.74 MAPK14 (0.35) MAPK14
SCHEMBL2056254 0.74 MAOB (0.40) CYP1A2CYP2A6MAPK14
SCHEMBL31256746 0.74 TDO2 (0.50) CYP1A2MAPK14TSHRKMT2AL3MBTL1
Ethane SCHEMBL9369863 0.71 KDM4E (0.38) CYP1A2MAPK14TSHRKMT2A
SCHEMBL16597607 0.70
SCHEMBL20778920 0.69 TDO2 (0.37) MAPK14LMNAMAPTKMT2AL3MBTL1
SCHEMBL29713452 0.69 HTT (0.44) CYP2A6PSMB8PSMB5MAPK14TSHR
SCHEMBL31256742 0.69 TDO2 (0.48) MAPK14TSHRMAPTKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420464-B1 3-Isoxazolone derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 1994-07-13 EP disclosed
US-5321037-A Isoxazole derivatives for use as cerebro-active drugs and central muscle relaxants SANKYO COMPANY, LIMITED (JP) 1994-06-14 US disclosed
EP-0335723-B1 ISOXAZOLE DERIVATIVES FOR USE AS CEREBRO-ACTIVE DRUGS AND CENTRAL MUSCLE RELAXANTS Sankyo Company Limited (JP) 1991-12-04 EP disclosed
EP-0420464-A2 3-Isoxazolone derivatives, their preparation and their therapeutic uses Sankyo Company Limited (JP) 1991-04-03 EP disclosed
EP-0335723-A1 Isoxazole derivatives for use as cerebro-active drugs and central muscle relaxants Sankyo Company Limited (JP) 1989-10-04 EP disclosed
US-4585472-A PRE- AND POSTEMERGENCE HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1986-04-29 US disclosed