SCHEMBL17015339

SCHEMBL17015339

c1ccc(-n2ccc3ccc4c5ccccc5n(-c5cc6ccccc6c6ccccc56)c4c32)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TDP1 Q9NUW8 1/20 0.35
BIRC5 O15392 1/20 0.33
HPRT1 P00492 2/20 0.33
PGR P06401 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TERT O14746 1/20 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
SCHEMBL17015337 0.87 KDM4E (0.39) CYP1A2CYP2C9CYP2C19KDM4EATM
SCHEMBL17015349 0.86 KDM4E (0.40) CYP1A2KDM4EATML3MBTL1BIRC5
SCHEMBL17015573 0.85 CYP1A2 (0.35) CYP1A2CYP2C9CYP2C19KDM4EATM
SCHEMBL15213666 0.85 KDM4E (0.52) KDM4EATML3MBTL1BIRC5PGR
SCHEMBL17228248 0.85 L3MBTL1 (0.52) CYP1A2CYP2C9CYP2C19KDM4EATM
SCHEMBL17016210 0.85 KDM4E (0.42) CYP1A2CYP2C9CYP2C19KDM4EATM
SCHEMBL17015188 0.85 KDM4E (0.39) CYP1A2CYP2C9CYP2C19KDM4EATM
SCHEMBL17016215 0.84 KDM4E (0.38) KDM4EATML3MBTL1TDP1BIRC5
SCHEMBL17015340 0.84 KDM4E (0.38) KDM4EATML3MBTL1TDP1BIRC5
SCHEMBL17015328 0.84 KDM4E (0.41) CYP1A2CYP2C9CYP2C19KDM4EATM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9837618-B2 Compound and organic electroluminescence device including thesame DOOSAN CORPORATION (KR) 2017-12-05 US disclosed
US-9837618-B2 Compound and organic electroluminescence device including thesame DOOSAN CORPORATION (KR) 2017-12-05 US disclosed
US-20150236272-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THESAME DOOSAN CORPORATION (KR) 2015-08-20 US disclosed
US-20150236272-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THESAME DOOSAN CORPORATION (KR) 2015-08-20 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 (1 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-20150236272-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THESAME INMT, IDO1, IDO2 CYP1A2 950/4885CYP2C9 1181/4885CYP2C19 1714/4885

“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.