SCHEMBL7677463

SCHEMBL7677463

CON=C(C1=NOCCO1)c1ccccc1C=NN=C(C)c1cccc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ POLB P06746 3/20 0.35
▸ NPSR1 Q6W5P4 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ PTBP1 P26599 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 3/20 0.33
▸ GAA P10253 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ RAB9A P51151 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ CTNNB1 P35222 1/20 0.32

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
SCHEMBL8080387 1.00 KMT2A (0.35) KMT2AKDM4EPOLBNPSR1HTT
SCHEMBL7677689 0.91 RAB9A (0.33) RAB9A
SCHEMBL7684458 0.81 RAB9A (0.33) RAB9A
SCHEMBL7684877 0.81 RAB9A (0.31) RAB9A
SCHEMBL7961405 0.78 MAOB (0.35) KMT2AKDM4EPOLBNPSR1HTT
SCHEMBL7961402 0.78 MAOB (0.35) KMT2AKDM4EPOLBNPSR1HTT
SCHEMBL6559723 0.77 LMNA (0.34) KMT2AKDM4EHTTLMNAMEN1
SCHEMBL8026715 0.76 HIF1A (0.47) KMT2AKDM4EPOLBNPSR1HTT
SCHEMBL7683910 0.75 ALDH1A1 (0.32) ALDH1A1CTNNB1WNT3A
SCHEMBL7661588 0.71 KMT2A (0.46) KMT2AKDM4EPOLBNPSR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420362-B1 Azines containing the 5,6-di-hydro-(1,4,2) dioxazine-3-yl group and the use thereof as fungicides BAYER AKTIENGESELLSCHAFT (DE) 2002-07-16 — — US disclosed
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