SCHEMBL17833690

SCHEMBL17833690

CCc1ccc(N(c2ccccc2)c2ccc3c(-c4ccccc4)c4cc(N(c5ccccc5)c5ccc(CC)cc5)ccc4c(-c4ccccc4)c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.39
ACHE P22303 4/20 0.37
CYP1A2 P05177 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KIF11 P52732 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPKAPK2 P49137 1/20 0.33
CYP2A6 P11509 1/20 0.33
CHKA P35790 3/20 0.33
CHKB Q9Y259 1/20 0.33
CTSV O60911 1/20 0.33

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
SCHEMBL195669 0.88 ALDH1A1 (0.43) ACHECYP1A2KDM4EALDH1A1CYP3A4
SCHEMBL13886632 0.88 ALDH1A1 (0.43) ACHECYP1A2KDM4EALDH1A1CYP3A4
SCHEMBL17833692 0.88 MCL1 (0.35) TP53ACHECYP1A2KDM4EALDH1A1
SCHEMBL36956 0.87 L3MBTL1 (0.42) TP53ACHECYP1A2KDM4EALDH1A1
SCHEMBL4650027 0.87 L3MBTL1 (0.42) TP53ACHECYP1A2KDM4EALDH1A1
SCHEMBL17833694 0.85 DHODH (0.36) KDM4EALDH1A1MAPTCYP2C9MEN1
SCHEMBL17833691 0.85 HSD11B1 (0.43) ALDH1A1CTSVCTSL
SCHEMBL17833697 0.85 KDM4E (0.35) ACHECYP1A2KDM4EALDH1A1CYP3A4
SCHEMBL13615687 0.85 ALDH1A1 (0.41) ACHECYP1A2KDM4EALDH1A1CYP3A4
SCHEMBL14099683 0.85 ALDH1A1 (0.41) ACHECYP1A2KDM4EALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210104680-A1 ORGANIC ELECTROLUMINESCENT ELEMINT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2021-04-08 US disclosed
US-20160211462-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMIRSU KOSAN CO., LTD. (JP) 2016-07-21 US disclosed
US-20160211462-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMIRSU KOSAN CO., LTD. (JP) 2016-07-21 US disclosed
US-20160172602-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 US disclosed
US-20160172602-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 US disclosed