SCHEMBL19276006

SCHEMBL19276006

c1cncc(-c2cccc(-c3cc(-c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c4)nc(-c4cccc(-c5cccnc5)c4)n3)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.41
▸ KMO O15229 1/20 0.40
▸ CYP19A1 P11511 2/20 0.40
▸ CYP11B1 P15538 2/20 0.40
▸ CYP11B2 P19099 2/20 0.40
▸ CYP17A1 P05093 1/20 0.40
▸ DHODH Q02127 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ PGR P06401 1/20 0.38
▸ PSIP1 O75475 1/20 0.38
▸ AXL P30530 1/20 0.38
▸ MKNK1 Q9BUB5 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ PIK3CA P42336 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ RAD51 Q06609 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36

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
SCHEMBL24812278 0.98 CYP19A1 (0.44) GRM5KMOCYP19A1CYP11B1CYP11B2
SCHEMBL17853621 0.96 KMO (0.42) GRM5KMOCYP19A1CYP11B1CYP11B2
SCHEMBL24252584 0.89 CYP19A1 (0.48) CYP19A1CYP11B1CYP11B2DHODHMEN1
SCHEMBL19397671 0.88 DHODH (0.48) CYP19A1CYP11B1CYP11B2CYP17A1DHODH
SCHEMBL21945892 0.88 CYP19A1 (0.46) GRM5KMOCYP19A1DHODHMEN1
SCHEMBL17853603 0.88 DHODH (0.48) CYP19A1CYP11B1CYP11B2CYP17A1DHODH
SCHEMBL17853612 0.88 DHODH (0.48) CYP19A1CYP11B1CYP11B2CYP17A1DHODH
SCHEMBL8400371 0.87 MEN1 (0.44) KMOMEN1MAPTALDH1A1KDM4E
SCHEMBL30107765 0.87 DHODH (0.43) GRM5CYP19A1CYP11B1CYP11B2CYP17A1
SCHEMBL17853490 0.87 DHODH (0.45) GRM5KMOCYP19A1CYP11B1CYP11B2

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-20170244044-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-08-24 — — US disclosed
US-20170244044-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-08-24 — — US disclosed
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