SCHEMBL21249208

SCHEMBL21249208

c1ccc2cc(-c3c4ccccc4c(-c4ccc5cc(-c6ccc7cc(-c8c9ccccc9c(-c9cc%10ccccc%10c%10ccccc9%10)c9cnccc89)c8ccccc8c7c6)ccc5c4)c4cnc5ccccc5c34)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 2/20 0.38
▸ MAPK10 P53779 6/20 0.37
▸ CYP17A1 P05093 1/20 0.36
▸ CYP19A1 P11511 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ PIK3CA P42336 3/20 0.34
▸ PIK3CD O00329 2/20 0.34
▸ MTOR P42345 2/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ MAPK9 P45984 2/20 0.34
▸ PDGFRB P09619 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ MET P08581 1/20 0.33
▸ TDO2 P48775 2/20 0.33
▸ CYP2A6 P11509 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GPR3 P46089 1/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ CCNC P24863 2/20 0.31

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
SCHEMBL1103501 0.88 KDM4E (0.41) CYP11B1MAPK10CYP17A1CYP19A1CYP11B2
SCHEMBL1102714 0.85 CYP11B1 (0.50) CYP11B1MAPK10CYP17A1CYP19A1CYP11B2
SCHEMBL1103375 0.82 KDM4E (0.42) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA
SCHEMBL1103522 0.82 KDM4E (0.42) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA
SCHEMBL1103452 0.81 KDM4E (0.43) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA
SCHEMBL1103719 0.81 KDM4E (0.43) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA
SCHEMBL1103519 0.80 ESR1 (0.41) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA
SCHEMBL1103463 0.80 MET (0.41) CYP11B1MAPK10CYP17A1CYP19A1CYP11B2
SCHEMBL1103446 0.80 ESR1 (0.43) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA
SCHEMBL1103507 0.79 CYP17A1 (0.41) CYP11B1CYP17A1CYP19A1CYP11B2PIK3CA

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-10381569-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-08-13 — — US disclosed
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