SCHEMBL10338441

SCHEMBL10338441

O=c1[nH]c2ccc(Nc3ccncc3)cc2s1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 5/20 0.60
▸ PDE3A Q14432 5/20 0.60
▸ KIF11 P52732 1/20 0.57
▸ SYK P43405 1/20 0.52
▸ MKNK1 Q9BUB5 5/20 0.51
▸ KMT2A Q03164 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ POLB P06746 1/20 0.47
▸ TP53 P04637 1/20 0.45
▸ MAPT P10636 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ PKM P14618 1/20 0.44

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
SCHEMBL10338289 0.76 PDE3B (0.57) PDE3BPDE3AKMT2AKDM4EMEN1
SCHEMBL12361999 0.75 PDE3B (0.54) PDE3BPDE3AKIF11SYKMKNK1
SCHEMBL16208489 0.73 KIF11 (1.00) KIF11SYKKMT2AMEN1POLB
SCHEMBL24897524 0.72 KIF11 (0.53) KIF11SYKMKNK1KMT2AKDM4E
SCHEMBL31191602 0.72 KIF11 (0.53) KIF11SYKMKNK1KMT2AKDM4E
SCHEMBL10338403 0.71 PDE3B (0.61) PDE3BPDE3ASYKKDM4EPOLB
SCHEMBL12433112 0.71 PDE3B (0.59) PDE3BPDE3A
SCHEMBL18175838 0.70 KIF11 (0.46) PDE3BPDE3AKIF11SYKMKNK1
SCHEMBL14651169 0.69 SYK (1.00) SYK
SCHEMBL15618645 0.69 MKNK1 (0.66) KIF11SYKMKNK1POLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2059578-A — — None — — JP disclosed
JP-H0259578-A BENZOTHIAZOLONE DERIVATIVE OR SALT THEREOF MITSUBISHI KASEI CORP 1990-02-28 — — JP disclosed
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