SCHEMBL18619355

SCHEMBL18619355

O=Nc1c(Cl)cccc1-c1cccc2c1oc1ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.48
▸ PRKDC P78527 4/20 0.43
▸ PIK3CD O00329 1/20 0.43
▸ PIK3CB P42338 1/20 0.43
▸ AHR P35869 4/20 0.43
▸ PIM1 P11309 1/20 0.41
▸ CSNK2A2 P19784 1/20 0.41
▸ CSNK2B P67870 1/20 0.41
▸ PIM3 Q86V86 1/20 0.41
▸ PIM2 Q9P1W9 1/20 0.41
▸ NMUR2 Q9GZQ4 1/20 0.40
▸ CCNC P24863 1/20 0.39
▸ CDK8 P49336 1/20 0.39
▸ GGPS1 O95749 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TTR P02766 1/20 0.35
▸ PTGES2 Q9H7Z7 1/20 0.35

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
SCHEMBL21037626 0.82 ALOX5 (0.57) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL22129979 0.81 ALOX5 (0.55) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL23058704 0.80 ALOX5 (0.54) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL10945864 0.79 ALOX5 (0.68) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL18619449 0.78 ALOX5 (0.53) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL22737844 0.77 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL18732156 0.77 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL5028273 0.77 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL431458 0.77 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBAHR
SCHEMBL430138 0.77 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBAHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10703762-B2 Compound, material for organic electroluminescence device, organic electroluminescence device and electronic apparatus IDEMITSU KOSAN CO., LTD. (JP) 2020-07-07 — — US disclosed
WO-2017038728-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2017-03-09 — — 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-10703762-B2 Compound, material for organic electroluminescence device, organic electroluminescence device and electronic apparatus PIEZO1, OR10J3, EPCAM ALOX5 2359/4885PRKDC 4104/4885PIK3CD 4639/4885

“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.

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