SCHEMBL12833264

SCHEMBL12833264

C=Cc1ccc2cc(N(c3ccccc3)c3ccc4ccccc4c3)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.46
ALDH1A1 P00352 5/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TSHR P16473 1/20 0.38
PTGS1 P23219 1/20 0.38
MAPT P10636 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NQO2 P16083 2/20 0.36
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35

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
SCHEMBL12998979 0.97 ALDH1A1 (0.40) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL12833571 0.95 RELA (0.41) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL14854548 0.95 ALDH1A1 (0.43) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL12833259 0.95 RELA (0.46) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL10165337 0.93 RELA (0.38) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL10165994 0.91 ALDH1A1 (0.41) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL18804470 0.90 ALDH1A1 (0.42) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL10165342 0.90 RELA (0.40) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL12833270 0.89 TDP1 (0.40) RELAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL12848032 0.88 RELA (0.38) RELAALDH1A1L3MBTL1KDM4EPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9391282-B2 Heterocyclic compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-12 US disclosed
US-9391282-B2 Heterocyclic compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-12 US disclosed
US-9391282-B2 Heterocyclic compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-12 US disclosed
EP-2769977-B1 Heterocyclic Compound and Organic Light-Emitting Diode including the same SAMSUNG DISPLAY CO LTD (KR) 2015-10-14 EP disclosed
EP-2769977-B1 Heterocyclic Compound and Organic Light-Emitting Diode including the same SAMSUNG DISPLAY CO LTD (KR) 2015-10-14 EP disclosed
US-20140239260-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-08-28 US disclosed
US-20140239260-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-08-28 US disclosed
US-20140239260-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-08-28 US disclosed
EP-2769977-A1 Heterocyclic Compound and Organic Light-Emitting Diode including the same Samsung Display Co., Ltd. (KR) 2014-08-27 EP disclosed
EP-2769977-A1 Heterocyclic Compound and Organic Light-Emitting Diode including the same Samsung Display Co., Ltd. (KR) 2014-08-27 EP disclosed
US-20110063485-A1 PHOTOELECTRIC CONVERSION DEVICE, PRODUCTION METHOD THEREOF, PHOTOSENSOR, IMAGING DEVICE AND THEIR DRIVE METHODS FUJIFILM CORPORATION (JP) 2011-03-17 US disclosed
US-20110056562-A1 PHOTOELECTRIC CONVERSION MATERIAL, FILM CONTAINING THE MATERIAL, PHOTOELECTRIC CONVERSION DEVICE, PRODUCTION METHOD THEREOF, PHOTOSENSOR, IMAGING DEVICE AND THEIR USE METHODS FUJIFILM CORPORATION (JP) 2011-03-10 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-20110056562-A1 PHOTOELECTRIC CONVERSION MATERIAL, FILM CONTAINING THE MATERIAL, PHOTOELECTRIC CONVERSION DEVICE, PRODUCTION METHOD THEREOF, PHOTOSENSOR, IMAGING DEVICE AND THEIR USE METHODS H1-0, CRY1, PYM1 RELA 1880/4885ALDH1A1 1266/4885L3MBTL1 128/4885
US-20110063485-A1 PHOTOELECTRIC CONVERSION DEVICE, PRODUCTION METHOD THEREOF, PHOTOSENSOR, IMAGING DEVICE AND THEIR DRIVE METHODS PPOX, CRY1, FTO RELA 3158/4885ALDH1A1 1665/4885L3MBTL1 4391/4885

“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.