SCHEMBL6901764

SCHEMBL6901764

O=C(NCCc1ncc(Cl)cc1Cl)c1c(Cl)ccnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.40
MAOB P27338 1/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
TAAR1 Q96RJ0 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
AKT3 Q9Y243 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
MAPT P10636 1/20 0.36
GLA P06280 1/20 0.36

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
SCHEMBL6030405 0.88 P2RX7 (0.43) P2RX7KMT2APOLBSMN1; SMN2LMNA
SCHEMBL319697 0.88 KMT2A (0.41) P2RX7MAOBKMT2APOLBNPC1
SCHEMBL6888143 0.87 POLB (0.46) P2RX7MAOBKMT2APOLBNPC1
SCHEMBL4614052 0.83 KMT2A (0.39) P2RX7KMT2APOLBNPC1RAB9A
SCHEMBL6905404 0.81 TAAR1 (0.43) P2RX7KMT2APOLBNPC1RAB9A
SCHEMBL3430687 0.81 LMNA (0.42) P2RX7MAOBKMT2ANPC1RAB9A
SCHEMBL6480960 0.76 POLB (0.40) P2RX7KMT2APOLBNPC1SMN1; SMN2
SCHEMBL68385 0.76 POLB (0.40) P2RX7KMT2APOLBNPC1RAB9A
SCHEMBL3430049 0.75 P2RX7 (0.48) P2RX7KMT2APOLBNPC1RAB9A
SCHEMBL28048682 0.74 POLB (0.52) MAOBPOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1322614-A2 PYRIDINYL AMIDES AND IMIDES FOR USE AS FUNGICIDES E. I. du Pont de Nemours and Company (US) 2003-07-02 EP claimed
WO-2002022583-A2 PYRIDINYL AMIDES AND IMIDES FOR USE AS FUNGICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2002-03-21 WO claimed
EP-1485355-A2 PYRIDINYL AMIDES AND COMPOSITIONS THEREOF FOR USE AS FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-12-15 EP disclosed
WO-2003080576-A2 PYRIDINYL AMIDES AND COMPOSITIONS THEREOF FOR USE AS FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-10-02 WO disclosed