SCHEMBL456798

SCHEMBL456798

Fc1ccc(-c2ccccc2)cc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPK1 P28482 2/20 0.48
HSD17B1 P14061 2/20 0.42
HSD17B2 P37059 2/20 0.42
CYP1A2 P05177 1/20 0.42
ALOX5 P09917 1/20 0.41
ACLY P53396 5/20 0.41
AKR1C4 P17516 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
PGR P06401 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
MAOA P21397 1/20 0.38
KIF11 P52732 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
SCHEMBL30318876 1.00 CRHBP (0.50) CRHBPCRHR2ALDH1A1MAPK1HSD17B1
SCHEMBL4352639 0.88 PARP1 (0.42) CRHBPCRHR2HSD17B1HSD17B2CYP1A2
SCHEMBL18782552 0.84 MAOB (0.39) HSD17B1HSD17B2CYP11B1CYP11B2PGR
SCHEMBL20597621 0.82 MEN1 (0.46) CRHBPCRHR2ALDH1A1MAPK1CYP1A2
SCHEMBL30285974 0.82 ALDH1A1 (0.54) CRHBPCRHR2ALDH1A1MAPK1HSD17B1
SCHEMBL1042606 0.82 ALDH1A1 (0.54) CRHBPCRHR2ALDH1A1MAPK1HSD17B1
SCHEMBL31348999 0.80 ESR2 (0.50) HSD17B1HSD17B2ALOX5KIF11MEN1
SCHEMBL8383368 0.80 TAAR1 (0.50) ALDH1A1MAPK1KIF11KDM4EMEN1
SCHEMBL22578248 0.79 MEN1 (0.51) ALDH1A1MAPK1MAOAKDM4EMEN1
Sulfur Dioxide SCHEMBL23270393 0.79 PARP1 (0.41) HSD17B1HSD17B2IDO1TDO2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559510-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2026-02-24 US disclosed
US-20230048904-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES UDC IRELAND LIMITED (IE) 2023-02-16 US disclosed
US-20230048904-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES UDC IRELAND LIMITED (IE) 2023-02-16 US disclosed
EP-4034542-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2022-08-03 EP disclosed
CN-114401973-A Material for organic electroluminescent device 默克专利有限公司 2022-04-26 CN disclosed
WO-2021058406-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-04-01 WO disclosed
WO-2021058406-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-04-01 WO disclosed
EP-2614053-A1 METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2013-07-17 EP disclosed
WO-2012033225-A1 METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-15 WO disclosed
US-7915455-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-29 US disclosed
EP-2272852-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex Sumitomo Chemical Company, Limited (JP) 2011-01-12 EP disclosed
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED 2009-06-04 US disclosed
US-7482414-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-27 US disclosed
US-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 US disclosed
EP-1683802-A1 TRANSITION METAL COMPLEX LIGAND AND OLEFIN POLYMERIZATION CATALYST CONTAINING TRANSITION METAL COMPLEX Sumitomo Chemical Company, Limited (JP) 2006-07-26 EP 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-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 CRHBP 2955/4885CRHR2 2365/4885ALDH1A1 4017/4885
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 CRHBP 2955/4885CRHR2 2365/4885ALDH1A1 4017/4885
US-20230048904-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM CRHBP 4275/4885CRHR2 4342/4885ALDH1A1 33/4885
US-12559510-B2 Materials for organic electroluminescent devices RPL39, SCO2, RPL37A CRHBP 4182/4885CRHR2 1100/4885ALDH1A1 325/4885

“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.