SCHEMBL22240787

SCHEMBL22240787

Bc1ccc2c(c1)oc1cc(-c3ccc4c5ccccc5c5ccccc5c4c3)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.42
▸ MAPT P10636 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HCRTR1 O43613 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ MMP12 P39900 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ LMNA P02545 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35

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
SCHEMBL22240827 0.89 PLA2G2A (0.43) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL12175698 0.85 AHR (0.57) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL1635833 0.85 AHR (0.47) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL21648503 0.84 AHR (0.52) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL16904367 0.83 AHR (0.55) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL1637850 0.83 AHR (0.46) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL12325043 0.83 AHR (0.59) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL17231580 0.81 AHR (0.53) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL17231570 0.81 AHR (0.53) AHRMAPTMEN1KMT2AKDM4E
SCHEMBL12037136 0.81 HCRTR1 (0.47) AHRMAPTMEN1KMT2AKDM4E

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
EP-3683217-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT Materials Co., Ltd. (KR) 2020-07-22 — — EP disclosed
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