SCHEMBL2857565

SCHEMBL2857565

[CH]1C(c2ccccc2)=C(c2ccccc2)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.39
HSD17B10 Q99714 4/20 0.39
P2RX7 Q99572 1/20 0.35
HPGD P15428 2/20 0.34
BCL2L1 Q07817 1/20 0.34
CYP2A6 P11509 1/20 0.34
MAPK1 P28482 1/20 0.34
MAPT P10636 4/20 0.34
FGFR1 P11362 2/20 0.34
FGFR2 P21802 2/20 0.34
FGFR4 P22455 2/20 0.34
FGFR3 P22607 2/20 0.34
HTT P42858 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MITF O75030 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
LMNA P02545 4/20 0.32
SRC P12931 1/20 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
SCHEMBL5916017 0.83 ALDH1A1 (0.44) ALDH1A1HSD17B10P2RX7HPGDBCL2L1
SCHEMBL2965426 0.76 CYP2A6 (0.43) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL216368 0.76 ALDH1A1 (0.38) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL2960805 0.76 ALDH1A1 (0.43) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL28025979 0.76 ALDH1A1 (0.41) ALDH1A1HSD17B10P2RX7HPGDMAPT
SCHEMBL18691988 0.75 ALDH1A1 (0.47) ALDH1A1HSD17B10P2RX7HPGDBCL2L1
SCHEMBL28025480 0.71 TP53 (0.38) ALDH1A1HSD17B10P2RX7HPGDBCL2L1
SCHEMBL28025453 0.71 CDC25A (0.44) ALDH1A1HSD17B10P2RX7MAPTFGFR1
SCHEMBL217176 0.71 ALDH1A1 (0.34) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL8524145 0.71 ALDH1A1 (0.34) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6

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
CN-111729688-B Application of single cyclopentadienyl fourth subgroup metal complex containing neutral coordination side group 吉林大学 2021-08-17 CN claimed
CN-111094223-B binaphthyl compounds 罗伊特化学仪器制造公司 2023-10-27 CN disclosed
US-11072573-B2 Binaphthyl compounds REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2021-07-27 US disclosed
US-20200354299-A1 BINAPHTHYL COMPOUNDS REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2020-11-12 US disclosed
CN-111094223-A Binaphthyl compounds 罗伊特化学仪器制造公司 2020-05-01 CN disclosed
EP-1964860-B1 ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER TOSOH CORP (JP) 2017-07-05 EP disclosed
EP-1473323-B1 Polyethylene composition and process for producing same TOSOH CORP (JP) 2016-04-27 EP disclosed
US-7838611-B2 Ethylene polymer, catalyst for ethylene polymer production, and method for producing ethylene polymer TOSOH CORPORATION (JP) 2010-11-23 US disclosed
US-7678866-B2 Polyethylene composition and process for producing same TOSOH CORPORATION (JP) 2010-03-16 US disclosed
US-20090137755-A1 ETHYLENE POLYMER, CATALYST FOR ETHYLENE POLYMER PRODUCTION, AND METHOD FOR PRODUCING ETHYLENE POLYMER TOSOH CORPORATION (JP) 2009-05-28 US disclosed
EP-1964860-A1 ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER Tosoh Corporation (JP) 2008-09-03 EP disclosed
US-7166684-B2 Transition metal compound, catalyst for olefin polymerization and method for producing polyolefin JAPAN POLYETHYLENE CORPORATION (JP) 2007-01-23 US disclosed
US-20060167196-A1 Novel transition metal compound, catalyst for olefin polymerization and method for producing polyolefin JAPAN POLYETHYLENE CORPORATION (JP) 2006-07-27 US disclosed
EP-1473323-A1 Polyethylene composition and process for producing same Tosoh Corporation (JP) 2004-11-03 EP disclosed
US-20040214953-A1 Polyethylene composition and process for producing same TOSOH CORPORATION 2004-10-28 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 (3 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-20200354299-A1 BINAPHTHYL COMPOUNDS UACA, C9, C1S ALDH1A1 1476/4885HSD17B10 1245/4885P2RX7 3799/4885
US-20060167196-A1 Novel transition metal compound, catalyst for olefin polymerization and method for producing polyolefin PCLAF, ZKSCAN2, POF1B ALDH1A1 2910/4885HSD17B10 2089/4885P2RX7 4855/4885
US-11072573-B2 Binaphthyl compounds UACA, C9, C1S ALDH1A1 1476/4885HSD17B10 1245/4885P2RX7 3799/4885

“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.