SCHEMBL26490571

SCHEMBL26490571

c1ccc(N(c2ccc3c(c2)oc2cc4ccccc4cc23)c2cccc3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 7/20 0.36
▸ DUSP3 P51452 1/20 0.34
▸ AHR P35869 2/20 0.33
▸ KDM4E B2RXH2 5/20 0.33
▸ HPGD P15428 5/20 0.33
▸ MAPT P10636 5/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ GLA P06280 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GAA P10253 2/20 0.31
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP1B1 Q16678 1/20 0.30
▸ NPC1 O15118 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
SCHEMBL17740677 0.94 SIGMAR1 (0.39) SIGMAR1DUSP3AHRKDM4EHPGD
SCHEMBL14295641 0.93 DUSP3 (0.33) SIGMAR1DUSP3AHRKDM4EHPGD
SCHEMBL23371104 0.92 SIGMAR1 (0.36) SIGMAR1AHRKDM4EHPGDMAPT
SCHEMBL26490587 0.92 KDM4E (0.38) SIGMAR1AHRKDM4EHPGDMAPT
SCHEMBL20209084 0.91 DUSP3 (0.32) SIGMAR1DUSP3AHRKDM4EHPGD
SCHEMBL21966511 0.91 KDM4E (0.37) SIGMAR1DUSP3AHRKDM4EHPGD
SCHEMBL22741277 0.91 SIGMAR1 (0.35) SIGMAR1AHRKDM4EHPGDMAPT
SCHEMBL21968724 0.90 KDM4E (0.38) SIGMAR1DUSP3AHRKDM4EHPGD
SCHEMBL22740341 0.90 SIGMAR1 (0.35) SIGMAR1KDM4EHPGDMAPTALDH1A1
SCHEMBL15851969 0.90 SIGMAR1 (0.35) SIGMAR1KDM4EHPGDMAPTALDH1A1

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-20230329025-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-10-12 — — US disclosed
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