SCHEMBL979162

SCHEMBL979162

Brc1cc2c3c(c1)Cc1cc(Br)cc(c1-3)CC2

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.32
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
SRD5A1 P18405 1/20 0.31
SRD5A2 P31213 1/20 0.31
PNMT P11086 1/20 0.31
ASIC3 Q9UHC3 1/20 0.31
BRD4 O60885 1/20 0.31

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
SCHEMBL1569413 0.91 PNMT (0.34) CYP19A1CYP11B1CYP11B2SRD5A1SRD5A2
SCHEMBL1004636 0.87 SLC6A2 (0.38) CYP19A1CYP11B1CYP11B2SRD5A1SRD5A2
SCHEMBL4411314 0.79 TDP1 (0.38) SRD5A1SRD5A2PNMTASIC3
SCHEMBL1698292 0.79 PTGS2 (0.38) SRD5A1SRD5A2
SCHEMBL8749812 0.74 TAS1R3 (0.32) SRD5A1
SCHEMBL25118730 0.72 ALDH1A1 (0.44) CYP11B1CYP11B2SRD5A1SRD5A2
SCHEMBL1698302 0.69 KDM1A (0.31) PNMTASIC3
SCHEMBL2995695 0.69 CYP3A4 (0.48)
SCHEMBL29336031 0.67
SCHEMBL13451237 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9773987-B2 Silicon-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-9773987-B2 Silicon-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-9705093-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-9705090-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-9705090-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-9640768-B2 Heterocyclic compound and orgainic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-02 US disclosed
US-9627634-B2 Heterocyclic compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-18 US disclosed
US-9567287-B2 Compound for organic light-emitting diode and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-14 US disclosed
US-9567287-B2 Compound for organic light-emitting diode and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-14 US disclosed
US-9567287-B2 Compound for organic light-emitting diode and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-14 US disclosed
US-7833635-B2 Organoelectroluminescent compound and organoelectroluminescent device employing the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-11-16 US disclosed
US-7781579-B2 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-08-24 US disclosed
US-7781579-B2 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-08-24 US disclosed
US-7781579-B2 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2010-08-24 US disclosed
US-20080093987-A1 Organoelectroluminescent compound and organoelectroluminescent device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2008-04-24 US disclosed
US-20080093987-A1 Organoelectroluminescent compound and organoelectroluminescent device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2008-04-24 US disclosed
US-20080093987-A1 Organoelectroluminescent compound and organoelectroluminescent device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2008-04-24 US disclosed
US-20070290610-A1 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2007-12-20 US disclosed
US-20070290610-A1 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2007-12-20 US disclosed
US-20070290610-A1 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2007-12-20 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-20070290610-A1 Cyclopentaphenanthrene-based compound and organic electroluminescent device using the same EML4, EED, LAGE3 CYP19A1 544/4885CYP11B1 1199/4885CYP11B2 1038/4885
US-20080093987-A1 Organoelectroluminescent compound and organoelectroluminescent device employing the same PPOX, EML4, ALPL CYP19A1 146/4885CYP11B1 554/4885CYP11B2 487/4885

“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.