SCHEMBL8735627

SCHEMBL8735627

c1ccc2cc(-c3c4ccccc4c(-c4ccc(-n5c6ccncc6c6cc(-c7ccncc7)ccc65)cc4)c4ccccc34)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
MAPK10 P53779 16/20 0.40
MAPK9 P45984 14/20 0.40
MAPK8 P45983 4/20 0.40
PIK3CD O00329 3/20 0.37
PIK3CA P42336 3/20 0.37
MTOR P42345 3/20 0.37
PIK3CB P42338 2/20 0.37
PIK3CG P48736 2/20 0.37

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
SCHEMBL17680043 0.95 CYP17A1 (0.44) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL6114362 0.95 CYP17A1 (0.44) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12168978 0.95 CYP17A1 (0.44) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL8737122 0.95 CYP17A1 (0.44) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12168985 0.94 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12169016 0.94 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12169020 0.94 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12098142 0.94 CYP17A1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL12442771 0.92 CYP17A1 (0.43) CYP17A1CYP19A1CYP11B1CYP11B2MAPK10
SCHEMBL6114410 0.92 CYP11B1 (0.40) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9755152-B2 Compound having substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2017-09-05 US disclosed
US-9755152-B2 Compound having substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2017-09-05 US disclosed
US-20150155496-A1 COMPOUND HAVING SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2015-06-04 US disclosed
US-20150155496-A1 COMPOUND HAVING SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2015-06-04 US disclosed
US-8927119-B2 Compound having substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2015-01-06 US disclosed
US-8927119-B2 Compound having substituted anthracene ring structure and pyridoindole ring structure, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2015-01-06 US disclosed
US-20120126220-A1 COMPOUND HAVING SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2012-05-24 US disclosed
US-20120126220-A1 COMPOUND HAVING SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2012-05-24 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 (2 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-20150155496-A1 COMPOUND HAVING SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE SLCO2B1, PNPO, SLCO2A1 CYP17A1 652/4885CYP19A1 334/4885CYP11B1 793/4885
US-20120126220-A1 COMPOUND HAVING SUBSTITUTED ANTHRACENE RING STRUCTURE AND PYRIDOINDOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE SLCO2B1, PNPO, SLCO2A1 CYP17A1 652/4885CYP19A1 334/4885CYP11B1 793/4885

“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.