SCHEMBL23920655

SCHEMBL23920655

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5oc6ccc7oc8cccc9c%10cc%11ccccc%11c3c%10c4c5c6c7c89)n2)cc1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.31
ABCG2 Q9UNQ0 3/20 0.31
CYP1A2 P05177 2/20 0.31
CYP1A1 P04798 1/20 0.31
FYN P06241 1/20 0.31
MAPK3 P27361 1/20 0.31
AHR P35869 1/20 0.31
PAX8 Q06710 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
MAPT P10636 1/20 0.30
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL23875021 0.99 TERT (0.31) TERTABCG2CYP1A2CYP1A1FYN
SCHEMBL23920653 0.93 NPC1 (0.32) TERTALDH1A1HPGDTSHRMAPT
SCHEMBL23920490 0.90
SCHEMBL23874712 0.87 TSHR (0.35) TERTABCG2CYP1A2ALDH1A1HPGD
SCHEMBL23874874 0.86 HPGD (0.40) ALDH1A1HPGDMAPTMAPK1HSD17B10
SCHEMBL23874873 0.86 ABCG2 (0.34) TERTABCG2CYP1A2CYP1A1FYN
SCHEMBL20315753 0.86 MAPT (0.34) TERTABCG2ALDH1A1HPGDTSHR
SCHEMBL20315763 0.86 PLA2G2A (0.33) TERTALDH1A1HPGDTSHRMAPT
SCHEMBL23874869 0.85 MAPT (0.34) TERTCYP1A2ALDH1A1HPGDTSHR
SCHEMBL23874715 0.85 NPC1 (0.35) TERTABCG2ALDH1A1HPGDTSHR

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-20210320263-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-14 US disclosed