SCHEMBL18798581

SCHEMBL18798581

c1ccc(-c2cccc(N(c3ccc4ccc5ccc(N(c6cccc(-c7ccccc7)c6)c6cccc7c6oc6ccccc67)c6ccc3c4c56)c3cccc4c3oc3ccccc34)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.34
CYP1B1 Q16678 3/20 0.34
CYP1A2 P05177 3/20 0.34
CYP1A1 P04798 2/20 0.34
PLA2G2A P14555 3/20 0.32
PLA2G4A P47712 3/20 0.32
PGR P06401 1/20 0.32
CYP19A1 P11511 2/20 0.31
EPHX2 P34913 1/20 0.31
PLA2G10 O15496 1/20 0.30
MAPT P10636 2/20 0.30
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
CSF1R P07333 1/20 0.30
PDGFRB P09619 1/20 0.30
KIT P10721 1/20 0.30
FLT3 P36888 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
GGPS1 O95749 1/20 0.30
JAK2 O60674 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
SCHEMBL4084581 1.00 ALOX5 (0.34) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL23849224 0.99 ALOX5 (0.33) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL20696437 0.98 CYP1A2 (0.35) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL18798587 0.93 JAK2 (0.34) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL4089280 0.93 JAK2 (0.34) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL18798570 0.92 CYP1A2 (0.35) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL24617947 0.92 ALOX5 (0.34) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL23512004 0.91 PGR (0.32) ALOX5CYP1B1CYP1A2CYP1A1PLA2G2A
SCHEMBL4089264 0.91 ALOX5 (0.35) ALOX5PLA2G2APLA2G4APGRCYP19A1
SCHEMBL2515170 0.90 ALOX5 (0.34) ALOX5CYP1A2PGRKMT2AMEN1

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-9640773-B2 Aromatic amine derivative and organic electroluminescence element using same IDEMITSU KOSAN CO., LTD. (JP) 2017-05-02 US disclosed
US-9640773-B2 Aromatic amine derivative and organic electroluminescence element using same IDEMITSU KOSAN CO., LTD. (JP) 2017-05-02 US disclosed