SCHEMBL10655729

SCHEMBL10655729

CCc1ccc2ncc(C(=O)N(O)c3ccccc3)c(O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.48
ALDH1A1 P00352 5/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
HPGD P15428 3/20 0.40
MAPT P10636 5/20 0.40
LMNA P02545 3/20 0.39
NMT2 O60551 2/20 0.39
NMT1 P30419 2/20 0.39
PDE4B Q07343 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
TACR1 P25103 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CFTR P13569 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
SCHEMBL10652338 0.82 MAPT (0.41) TP53ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL10653721 0.82 MEN1 (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL10654855 0.81 KDM4E (0.50) TP53ALDH1A1SMN1; SMN2HTTNPSR1
SCHEMBL10032038 0.81 TP53 (0.51) TP53ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL10652816 0.81 MGAM (0.40) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL10652200 0.79 TACR1 (0.41) TACR1
SCHEMBL11707476 0.79 TP53 (0.48) TP53ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11329170 0.77 TP53 (0.47) TP53ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL11066821 0.75 MEN1 (0.51) TP53ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL10656595 0.75 CHKA (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2HTT

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
EP-0168309-B1 ISOXAZOLOQUINOLINONE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1988-03-09 EP disclosed
US-4588731-A Derivatives of isoxazolo[4,5-c]quinoline(2H)-3-one and method of preparation and use as anxiolytic agents ROUSSEL UCLAF (FR) 1986-05-13 US disclosed
EP-0168309-A1 Isoxazoloquinolinone derivatives, process and intermediates for their preparation, use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1986-01-15 EP disclosed