SCHEMBL23032797

SCHEMBL23032797

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(-c4nc(-c5ccc(-c6ccc(-c7cccc8c7sc7ccccc78)cc6)cc5)nc(-c5ccc(-c6cccc7ccccc67)cc5)n4)ccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
F9 P00740 1/20 0.32
CA12 O43570 3/20 0.31
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
CA9 Q16790 3/20 0.31
PRKDC P78527 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL23032745 0.95 ALOX5 (0.43) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032803 0.94 ALOX5 (0.41) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032716 0.94 ALOX5 (0.44) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032709 0.93 ALOX5 (0.41) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032804 0.93 ALOX5 (0.41) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032807 0.92 ALOX5 (0.41) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032715 0.91 ALOX5 (0.41) ALOX5KDM4EMAPTSMN1; SMN2MEN1
SCHEMBL23032824 0.90 ALOX5 (0.42) ALOX5KDM4EMAPTSMN1; SMN2F9
SCHEMBL23033011 0.90 ALOX5 (0.45) ALOX5KDM4EMAPTMEN1LMNA
SCHEMBL23032708 0.89 ALOX5 (0.43) ALOX5KDM4EMAPTSMN1; SMN2MEN1

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
WO-2021033730-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2021-02-25 WO disclosed