SCHEMBL18732166

SCHEMBL18732166

Clc1ccc(-c2ccc3sc4ccccc4c3c2)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
GPR3 P46089 1/20 0.41
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTPN1 P18031 3/20 0.35
IDO1 P14902 1/20 0.34
CYP1A2 P05177 1/20 0.34
JAK2 O60674 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
PTPN7 P35236 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 1/20 0.33

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
SCHEMBL18732272 0.91 KDM4E (0.45) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL18732167 0.88 KDM4E (0.49) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL22892791 0.85 KDM4E (0.49) KDM4EGPR3ALOX5ALDH1A1IDO1
SCHEMBL22057993 0.85 KDM4E (0.51) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL30513581 0.83 GPR3 (0.48) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL19395164 0.83 GPR3 (0.48) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL23314362 0.82 KDM4E (0.64) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL25501456 0.82 KDM4E (0.43) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL23314019 0.82 KDM4E (0.49) KDM4EGPR3ALOX5ALDH1A1MAPT
SCHEMBL17383082 0.81 GPR3 (0.47) KDM4EGPR3ALOX5ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-06 US disclosed
US-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-07-06 US disclosed
EP-3345982-B1 DOUBLE SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEMICAL LTD (KR) 2020-03-18 EP disclosed
EP-3345982-A1 DOUBLE SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-11 EP disclosed
WO-2017061810-A1 DOUBLE SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2017-04-13 WO 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-20230217825-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME OR10J3, AOC2, EPCAM KDM4E 1669/4885GPR3 4663/4885ALOX5 693/4885

“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.