SCHEMBL11078628

SCHEMBL11078628

CONC(=O)c1ccccn1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.59
NPC1 O15118 4/20 0.59
RAB9A P51151 4/20 0.59
PKM P14618 3/20 0.59
MAPT P10636 1/20 0.59
HPGD P15428 1/20 0.56
CDK5 Q00535 1/20 0.56
PAX8 Q06710 1/20 0.56
CDK5R1 Q15078 1/20 0.56
ALPL P05186 1/20 0.56
HDAC3 O15379 1/20 0.56
HDAC4 P56524 1/20 0.56
HDAC1 Q13547 1/20 0.56
HDAC7 Q8WUI4 1/20 0.56
HDAC2 Q92769 1/20 0.56
HDAC10 Q969S8 1/20 0.56
HDAC11 Q96DB2 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
HDAC9 Q9UKV0 1/20 0.56

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
SCHEMBL3358628 1.00 SMN1; SMN2 (0.59) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL27772395 0.82 ALDH1A1 (0.56) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL28287259 0.82 GRM4 (0.54) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL11082962 0.81 SMN1; SMN2 (0.60) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL11082959 0.81 SMN1; SMN2 (0.60) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL30037891 0.79 ALDH1A1 (0.61) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL29576494 0.79 KDM4E (0.68) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL30166417 0.79 KDM4E (0.68) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL162189 0.79 ALDH1A1 (0.61) SMN1; SMN2NPC1RAB9APKMMAPT
SCHEMBL109657 0.79 HDAC3 (0.61) SMN1; SMN2NPC1RAB9AHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57120597-A None JP disclosed
EP-0065039-B1 AN O-(N-ALKOXY-PYRIDINECARBOXIMIDOYL)PHOSPHATE, A PROCESS FOR PRODUCING THE SAME, AND AN INSECTICIDAL OR ACARICIDAL COMPOSITION CONTAINING THE SAME ISHIHARA SANGYO KAISHA LTD. (JP) 1984-08-22 EP disclosed
EP-0065039-A1 An O-(N-alkoxy-pyridinecarboximidoyl)phosphate, a process for producing the same, and an insecticidal or acaricidal composition containing the same ISHIHARA SANGYO KAISHA LTD. (JP) 1982-11-24 EP disclosed
JP-S57120597-A ORGANOPHOSPHORUS COMPOUND AND INSECTICIDE CONTAINING THE SAME ISHIHARA SANGYO KAISHA LTD 1982-07-27 JP disclosed
US-4327089-A O-(N-Alkoxy-pyridinecarboximidoyl) phosphates, process for producing the same, and insecticidal or acaridical compositions containing the same ISHIHARA SANGYO KAISHA LTD. (JP) 1982-04-27 US disclosed