SCHEMBL12098380

SCHEMBL12098380

c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(-c6ccc7ccccc7c6)c6ccccc6c(-c6ccc7ccccc7c6)c5c4)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
MAPK10 P53779 9/20 0.38
MAPK9 P45984 8/20 0.38
GRM1 Q13255 1/20 0.37
MAPK8 P45983 3/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
CCNC P24863 2/20 0.35
CDK8 P49336 2/20 0.35
TDO2 P48775 2/20 0.34
SLC22A12 Q96S37 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
SCHEMBL12169057 0.99 CYP17A1 (0.41) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12098148 0.96 CYP17A1 (0.41) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12169070 0.96 CYP11B1 (0.41) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12442771 0.95 CYP17A1 (0.43) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL17366394 0.95 CYP11B1 (0.39) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12169016 0.95 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12168985 0.95 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12169020 0.95 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12098142 0.95 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12169028 0.94 CYP17A1 (0.44) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10

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 79 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3244465-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2022-04-20 EP disclosed
EP-3223330-B1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2022-02-23 EP disclosed
US-11158811-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2021-10-26 US disclosed
US-10892420-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2021-01-12 US disclosed
US-10818844-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-10-27 US disclosed
US-10693078-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-06-23 US disclosed
US-10593884-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-03-17 US disclosed
EP-3133665-B1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2020-03-04 EP disclosed
US-10566540-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-02-18 US disclosed
EP-3266781-B1 COMPOUND HAVING A SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2020-02-12 EP disclosed
US-8748014-B2 Compound having a substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2014-06-10 US disclosed
US-8748014-B2 Compound having a substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2014-06-10 US disclosed
US-8748014-B2 Compound having a substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2014-06-10 US disclosed
EP-2704225-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2014-03-05 EP disclosed
US-20140021451-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2014-01-23 US disclosed
US-20140021451-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2014-01-23 US disclosed
EP-2500346-A1 COMPOUND HAVING A SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2012-09-19 EP disclosed
US-20120228598-A1 COMPOUND HAVING A SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2012-09-13 US disclosed
US-20120228598-A1 COMPOUND HAVING A SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2012-09-13 US disclosed
US-20120228598-A1 COMPOUND HAVING A SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2012-09-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10593884-B2 Organic electroluminescent device AHR, SLC18A1, KCNH1 CYP17A1 355/4885CYP19A1 42/4885CYP11B1 272/4885
US-10693078-B2 Organic electroluminescent device KCNN2, SLC7A5, KCNH3 CYP17A1 1626/4885CYP19A1 638/4885CYP11B1 2460/4885
US-10818844-B2 Organic electroluminescent device AHR, ARNT, TRPV4 CYP17A1 1258/4885CYP19A1 365/4885CYP11B1 480/4885
US-10566540-B2 Organic electroluminescent device KCNN2, SLC7A5, KCNN1 CYP17A1 1181/4885CYP19A1 527/4885CYP11B1 1702/4885
US-10892420-B2 Organic electroluminescent device SLC7A5, KCNN2, SLC43A1 CYP17A1 1630/4885CYP19A1 626/4885CYP11B1 2072/4885
US-20120228598-A1 COMPOUND HAVING A SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE PNPO, OXA1L, NLRP1 CYP17A1 1511/4885CYP19A1 596/4885CYP11B1 654/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.