SCHEMBL13725904

SCHEMBL13725904

Cc1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc(-c6ccc(N(c7ccc8ccccc8c7)c7ccc8c(c7)c7ccccc7n8-c7ccc(C)cc7)cc6)cc5)cc4)c4ccc5ccccc5c4)ccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 2/20 0.37
AKR1C4 P17516 1/20 0.37
AKR1C3 P42330 1/20 0.37
AKR1C2 P52895 1/20 0.37
AKR1C1 Q04828 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
PER2 O15055 1/20 0.35
CRY1 Q16526 1/20 0.35
CRY2 Q49AN0 1/20 0.35
ALDH1A1 P00352 4/20 0.34
RAB9A P51151 1/20 0.34
CYP2A6 P11509 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 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
SCHEMBL13725381 0.94 TSPO (0.34) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL13725885 0.93 KDM4E (0.42) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL9912902 0.93 HTT (0.42) NPSR1L3MBTL1HTTKDM4EALDH1A1
SCHEMBL21974343 0.91 L3MBTL1 (0.39) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL21974347 0.91 L3MBTL1 (0.39) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL13725132 0.90 L3MBTL1 (0.33) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL13725692 0.90 L3MBTL1 (0.33) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL13291211 0.90 TSPO (0.35) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL13724932 0.90 KDM4E (0.44) NPSR1L3MBTL1HTTAKR1C4AKR1C3
SCHEMBL12242932 0.90 L3MBTL1 (0.47) NPSR1L3MBTL1HTTKDM4EATM

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-8394511-B2 Compound for forming organic film, and organic light emitting device and flat panel display device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2013-03-12 US disclosed
US-8394511-B2 Compound for forming organic film, and organic light emitting device and flat panel display device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2013-03-12 US disclosed
US-20090200928-A1 COMPOUND FOR FORMING ORGANIC FILM, AND ORGANIC LIGHT EMITTING DEVICE AND FLAT PANEL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2009-08-13 US disclosed
US-20090200928-A1 COMPOUND FOR FORMING ORGANIC FILM, AND ORGANIC LIGHT EMITTING DEVICE AND FLAT PANEL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2009-08-13 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 (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-20090200928-A1 COMPOUND FOR FORMING ORGANIC FILM, AND ORGANIC LIGHT EMITTING DEVICE AND FLAT PANEL DISPLAY DEVICE INCLUDING THE SAME SLCO4C1, PORCN, SLC7A5 NPSR1 4841/4885L3MBTL1 1723/4885HTT 1888/4885

“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.