SCHEMBL25112808

SCHEMBL25112808

CCn1c(-c2ncc(-c3cc4ccc5cccc6c7cccc8ccc9cccc(c(c3)c4c56)c9c87)cn2)nc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ HPGD P15428 4/20 0.44
▸ MAPT P10636 6/20 0.43
▸ HTT P42858 3/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ GRM5 P41594 1/20 0.42
▸ TP53 P04637 3/20 0.41
▸ RCE1 Q9Y256 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL25112869 0.91 KDM4E (0.47) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL25112812 0.87 MEN1 (0.45) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL25112772 0.85 NLRP3 (0.51) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL25112845 0.84 KDM4E (0.52) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL25112821 0.83 ESR1 (0.40) ALDH1A1KDM4EHPGDHTTCYP1A2
SCHEMBL25112704 0.83 KDM4E (0.48) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL25112867 0.80 MEN1 (0.48) ALDH1A1KDM4EHPGDMAPTHTT
SCHEMBL25112763 0.78 HTT (0.41) ALDH1A1KDM4EMAPTHTTCYP1A2
SCHEMBL25112774 0.77 ESR1 (0.41) ALDH1A1KDM4EHPGDMAPTCYP1A2
SCHEMBL25112883 0.74 BIRC5 (0.48) ALDH1A1HPGDMAPTCYP1A2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-03-16 — — 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 (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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, PIEZO1, LEF1 ALDH1A1 192/4885KDM4E 1371/4885HPGD 3868/4885

“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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