SCHEMBL27308516

SCHEMBL27308516

c1cc(-c2ccc(N(c3ccccc3-c3ccc4oc5cc6ccccc6cc5c4c3)c3cccc4c3ccc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ CYP1A1 P04798 1/20 0.31
▸ CYP1B1 Q16678 1/20 0.31
▸ ANO1 Q5XXA6 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL27307019 0.98 KDM4E (0.32) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27307895 0.95 KDM4E (0.36) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27307002 0.93 PRKDC (0.32) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27307020 0.92 KDM4E (0.32) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27308773 0.92 KDM4E (0.33) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27301921 0.91 CYP1A1 (0.37) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27307636 0.91 KDM4E (0.36) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27307641 0.91 GPR84 (0.34) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL24964091 0.90 PLA2G2A (0.35) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL27307189 0.90 ALDH1A1 (0.33) MAPTKDM4EALDH1A1HPGDTSHR

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-2023199832-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-19 — — WO disclosed
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