SCHEMBL8739934

SCHEMBL8739934

Brc1cccc(Cc2cccc(Br)n2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.46
MBOAT4 Q96T53 1/20 0.44
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
HTR7 P34969 2/20 0.37
HTR1A P08908 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
FAAH O00519 1/20 0.36
KCNH2 Q12809 3/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
ACKR3 P25106 1/20 0.32
GRIN2D O15399 2/20 0.32
GRIN3B O60391 2/20 0.32
GRIN1 Q05586 2/20 0.32

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
SCHEMBL17656042 0.87 MBOAT4 (0.44) PARP1MBOAT4KDM1AMAOAMAOB
SCHEMBL5498 0.84 BRD4 (0.49) PARP1MBOAT4KDM1AMAOAMAOB
SCHEMBL506617 0.82
SCHEMBL29561513 0.82
SCHEMBL906702 0.80
SCHEMBL378869 0.80
SCHEMBL243277 0.80
SCHEMBL13537005 0.80
SCHEMBL14157117 0.80
SCHEMBL3671171 0.80

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340728-B2 Organic electroluminescence device UDC IRELAND LIMITED (IE) 2016-05-17 US disclosed
US-9340728-B2 Organic electroluminescence device UDC IRELAND LIMITED (IE) 2016-05-17 US disclosed
US-20120309970-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LTD. (IE) 2012-12-06 US disclosed
US-20120309970-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LTD. (IE) 2012-12-06 US disclosed
US-8247091-B2 Platinum complex compound and organic electroluminescent device FUJIFILM CORPORATION (JP) 2012-08-21 US disclosed
US-8247091-B2 Platinum complex compound and organic electroluminescent device FUJIFILM CORPORATION (JP) 2012-08-21 US disclosed
US-8202631-B2 Light-emitting device FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-8202631-B2 Light-emitting device FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-20120126690-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION 2012-05-24 US disclosed
US-20120126690-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION 2012-05-24 US disclosed
US-20090309490-A1 LIGHT-EMITTING DEVICE UDC IRELAND LIMITED (IE) 2009-12-17 US disclosed
US-20090309490-A1 LIGHT-EMITTING DEVICE UDC IRELAND LIMITED (IE) 2009-12-17 US disclosed
US-20090167157-A1 ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2009-07-02 US disclosed
US-20090167157-A1 ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2009-07-02 US disclosed
US-20090128008-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE FUJIFILM CORPORATION (JP) 2009-05-21 US disclosed
US-20090128008-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE FUJIFILM CORPORATION (JP) 2009-05-21 US disclosed
US-7501190-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2009-03-10 US disclosed
US-7501190-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2009-03-10 US disclosed
US-20080001530-A1 Organic Electroluminescent Device UDC IRELAND LIMITED (IE) 2008-01-03 US disclosed
US-20080001530-A1 Organic Electroluminescent Device UDC IRELAND LIMITED (IE) 2008-01-03 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 (4 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-20090309490-A1 LIGHT-EMITTING DEVICE L1CAM, LIG1, CD274 PARP1 21/4885MBOAT4 4786/4885KDM1A 676/4885
US-20090128008-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE L1CAM, LIG1, ZC3HAV1L PARP1 180/4885MBOAT4 4835/4885KDM1A 2331/4885
US-20090167157-A1 ORGANIC ELECTROLUMINESCENT DEVICE L1CAM, ZYX, SOD1 PARP1 673/4885MBOAT4 3726/4885KDM1A 834/4885
US-20120309970-A1 PLATINUM COMPLEX COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE L1CAM, LIG1, ZC3HAV1L PARP1 180/4885MBOAT4 4835/4885KDM1A 2331/4885

“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.