SCHEMBL6527124

SCHEMBL6527124

Cc1ccc2c(C3=CCN(C(=O)O)CC3)cccc2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
HPGD P15428 2/20 0.47
USP2 O75604 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 1/20 0.40
PDK4 Q16654 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CCNT1 O60563 1/20 0.37
CDK9 P50750 1/20 0.37
TP53 P04637 1/20 0.37
NPC1 O15118 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL4170674 0.86 PDK4 (0.59) PDK4
SCHEMBL6711077 0.79 ALDH1A1 (0.56) LMNAHPGDUSP2ALDH1A1KDM4E
SCHEMBL20140095 0.78 HTR1A (0.54) LMNAHPGDUSP2HTTALDH1A1
SCHEMBL22324761 0.76 ALDH1A1 (0.47) LMNAHPGDALDH1A1PDK4SMN1; SMN2
SCHEMBL6812374 0.76 MAPT (0.44) LMNAHPGDUSP2HTTALDH1A1
SCHEMBL25171673 0.76 QDPR (0.47) LMNAHPGDUSP2HTTALDH1A1
SCHEMBL19284621 0.76 MAPT (0.47) LMNAHPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL15286283 0.74 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2CDK9ALOX15TSHR
SCHEMBL6808255 0.74 HTR1D (0.48) HPGDALDH1A1KDM4EPDK4SMN1; SMN2
SCHEMBL20740133 0.72 MAPT (0.47) LMNAHTTKDM4EMAPTMEN1

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-1562917-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2005-08-17 EP disclosed
WO-2004046124-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2004-06-03 WO disclosed