SCHEMBL20412640

SCHEMBL20412640

c1ccc2c(c1)ccc1cccc(-c3c4ccccc4c(-c4ccc5c(c4)oc4ccc6ccccc6c45)c4ccccc34)c12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 6/20 0.40
TDP1 Q9NUW8 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AHR P35869 4/20 0.39
PAX8 Q06710 2/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
FYN P06241 1/20 0.39
MAPK3 P27361 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL17944644 0.93 TDP1 (0.40) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL20127470 0.92 TDP1 (0.43) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL20412638 0.92 TDP1 (0.39) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL23427467 0.91 TDP1 (0.43) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL17944579 0.91 TDP1 (0.38) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL20127293 0.90 ABCG2 (0.41) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL10122697 0.90 TDP1 (0.46) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL17944091 0.90 ABCG2 (0.38) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL17931945 0.90 AHR (0.40) ABCG2TDP1L3MBTL1AHRPAX8
SCHEMBL20127546 0.90 ABCG2 (0.38) ABCG2TDP1L3MBTL1AHRPAX8

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180208836-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-07-26 US disclosed
US-20180208836-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-07-26 US disclosed