SCHEMBL10656286

SCHEMBL10656286

C1=CN(c2ccccc2)OC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
SIGMAR1 Q99720 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
AKR1C3 P42330 1/20 0.32
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
ADRB1 P08588 1/20 0.31
HTR3A P46098 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL10653566 0.78 HTR3E (0.35) LMNASIGMAR1NPC1RAB9AAKR1C3
SCHEMBL7976910 0.72 CA2 (0.47) LMNACYP2C19
SCHEMBL3098301 0.67 POLB (0.44) AKR1C3
SCHEMBL3136272 0.66 KDM4E (0.45) LMNANPC1RAB9AHTR3EHTR3B
SCHEMBL9892559 0.63 MGLL (0.42) LMNAMEN1NPC1RAB9AKMT2A
SCHEMBL2466051 0.63 LMNA (0.42) LMNASIGMAR1MEN1NPC1RAB9A
SCHEMBL3860610 0.62 LMNA (0.39) LMNASIGMAR1MEN1NPC1RAB9A
SCHEMBL5035351 0.62 LMNA (0.34) LMNASIGMAR1MEN1NPC1RAB9A
SCHEMBL1406399 0.62
SCHEMBL10582068 0.60 LMNA (0.46) LMNASIGMAR1MEN1NPC1RAB9A

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-0168309-B1 ISOXAZOLOQUINOLINONE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, USE AS MEDICAMENTS AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1988-03-09 EP claimed
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 claimed
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 claimed
EP-2585443-B1 PROCESS FOR PRODUCING IMINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2015-02-18 EP disclosed
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
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