SCHEMBL17265102

SCHEMBL17265102

c1ccc2c(c1)c1cnccc1n2-c1cc2c3ccccc3n3c4ccccc4c(c1)c23

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.48
MAOB P27338 4/20 0.48
ACHE P22303 3/20 0.48
KDM4E B2RXH2 2/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP2D6 P10635 1/20 0.42
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
TOP2A P11388 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
SLC6A2 P23975 2/20 0.35
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
RAD52 P43351 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL17265103 1.00 MAOA (0.48) MAOAMAOBACHEKDM4EATM
SCHEMBL17265105 0.90 MAOA (0.40) MAOAMAOBACHEKDM4EATM
SCHEMBL24528058 0.89 KDM4E (0.43) MAOAMAOBACHEKDM4EATM
SCHEMBL17265106 0.89 MAOA (0.43) MAOAMAOBACHEKDM4EATM
SCHEMBL17265107 0.89 MAOA (0.39) MAOAMAOBACHEKDM4EATM
SCHEMBL261895 0.87 MAOA (0.56) MAOAMAOBACHEKDM4EATM
SCHEMBL16356751 0.87 MAOA (0.56) MAOAMAOBACHEKDM4EATM
SCHEMBL16356750 0.87 MAOA (0.56) MAOAMAOBACHEKDM4EATM
SCHEMBL5021387 0.87 MAOA (0.56) MAOAMAOBACHEKDM4EATM
SCHEMBL17146739 0.85 KDM4E (0.56) KDM4EATML3MBTL1ALDH1A1POLB

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-9771373-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-09-26 US disclosed
US-9771373-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-09-26 US disclosed
US-20150333273-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-11-19 US disclosed
US-20150333273-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-11-19 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-20150333273-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNE2, CRY2 MAOA 1729/4885MAOB 1626/4885ACHE 2664/4885

“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.