SCHEMBL9687641

SCHEMBL9687641

O=c1sc2cc(F)c(-n3c(=O)n4n(c3=O)CCCC4)cc2n1Cc1ccon1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 4/20 0.34
TP53 P04637 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30
PKM P14618 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
HRH1 P35367 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL9687690 0.81 GRM7 (0.36)
SCHEMBL9874248 0.79 TP53 (0.34) TP53KMT2AKDM4EPKML3MBTL1
SCHEMBL9686547 0.78 GRIN1 (0.37) TMEM97
SCHEMBL9686590 0.77 LMNA (0.30) LMNAKMT2A
SCHEMBL9837325 0.76 TMEM97 (0.36) TMEM97ADRA2AADRA2BADRA2CHRH1
SCHEMBL9839357 0.76 SHMT2 (0.39) TMEM97KDM4EADRA2AADRA2BADRA2C
SCHEMBL9685828 0.76 TP53 (0.35) TP53LMNAKDM4EPKML3MBTL1
SCHEMBL9837580 0.72 TMEM97 (0.33) TMEM97
SCHEMBL10413738 0.72 SHMT2 (0.36) TMEM97KDM4E
SCHEMBL9687715 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0296416-B1 BENZO-ANELLATED CYCLIC COMPOUNDS NIHON BAYER AGROCHEM K.K. (JP) 1992-07-29 EP disclosed
US-5077401-A Herbicides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1991-12-31 US disclosed
US-4902335-A Benzo-fused cyclic compounds NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1990-02-20 US disclosed