SCHEMBL2601573

SCHEMBL2601573

O=[N+]([O-])c1ccccc1-c1ccc2ccc3c(Br)ccc4ccc1c2c43

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
S100A4 P26447 2/20 0.40
PTPRC P08575 1/20 0.40
HPRT1 P00492 1/20 0.39
MAOB P27338 1/20 0.39
NPC1 O15118 1/20 0.39
ABCB1 P08183 1/20 0.39
RAB9A P51151 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
PTPN1 P18031 2/20 0.38
GUSB P08236 1/20 0.38
F2 P00734 1/20 0.38

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
SCHEMBL10034237 1.00 ALDH1A1 (0.44) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL2601574 0.86 ALDH1A1 (0.51) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL14460527 0.85 ALDH1A1 (0.47) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL19301161 0.85 KMT2A (0.43) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL8819127 0.84 ALDH1A1 (0.52) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL2601604 0.84 CRHBP (0.41) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL10034250 0.84 CRHBP (0.41) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL10066150 0.82 ALDH1A1 (0.44) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL14330621 0.81 MAPT (0.36) ALDH1A1TDP1MAPTKMT2AMEN1
SCHEMBL14330619 0.81 MAPT (0.38) ALDH1A1TDP1MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2448035-B1 Organic light-emitting device SAMSUNG DISPLAY CO LTD (KR) 2014-06-11 EP disclosed
US-8546793-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2013-10-01 US disclosed
US-8546793-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2013-10-01 US disclosed
EP-2448035-A2 Organic light-emitting device Samsung Mobile Display Co., Ltd. (KR) 2012-05-02 EP disclosed
US-20120097925-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-04-26 US disclosed
US-20120097925-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-04-26 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-20120097925-A1 ORGANIC LIGHT-EMITTING DEVICE AR, NR2E3, CRY1 ALDH1A1 74/4885TDP1 2656/4885MAPT 1507/4885

“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.