SCHEMBL17015652

SCHEMBL17015652

c1ccc(-c2ccc(-n3ccc4c3ccc3c5ccccc5n(-c5cc6ccccc6c6ccccc56)c34)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
BIRC5 O15392 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTR7 P34969 1/20 0.32
MAOB P27338 1/20 0.30
NR3C1 P04150 1/20 0.30
HDAC4 P56524 1/20 0.30

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
SCHEMBL17015188 0.93 KDM4E (0.39) CYP1A2CYP2C9CYP2C19BIRC5KDM4E
SCHEMBL17015734 0.92 CYP1A2 (0.33) CYP1A2CYP2C9CYP2C19KDM4EATM
SCHEMBL17015650 0.89 GPR84 (0.34) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL17015647 0.88 PDPK1 (0.33) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL17015649 0.87 PDPK1 (0.35) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL17015662 0.87 BIRC5 (0.34) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL17015653 0.86 KDM4E (0.32) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL17015642 0.85 KDM4E (0.36) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL15632083 0.85 L3MBTL1 (0.43) BIRC5KDM4EATML3MBTL1HTR7
SCHEMBL16613787 0.85 L3MBTL1 (0.43) BIRC5KDM4EATML3MBTL1HTR7

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.