SCHEMBL18213914

SCHEMBL18213914

CC1(C)c2cc(-c3cc(-c4cccc(-n5c6ccc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)cc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)c4)nc(-c4ccccc4)n3)ccc2-c2ccc(-n3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PTGER4 P35408 1/20 0.36
▸ MEN1 O00255 6/20 0.34
▸ KMT2A Q03164 6/20 0.34
▸ ALDH1A1 P00352 6/20 0.34
▸ MAPT P10636 5/20 0.34
▸ HPGD P15428 5/20 0.34
▸ LMNA P02545 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ NTSR1 P30989 1/20 0.32
▸ PTGES O14684 1/20 0.32
▸ RXFP1 Q9HBX9 2/20 0.32
▸ NPY5R Q15761 1/20 0.31
▸ TSPO P30536 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ RXRA P19793 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30

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
SCHEMBL6375035 0.97 KDM4E (0.37) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385437 0.96 MEN1 (0.34) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385445 0.96 MEN1 (0.34) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385449 0.96 MEN1 (0.34) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385429 0.96 MEN1 (0.34) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385458 0.96 MEN1 (0.34) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385430 0.96 MEN1 (0.34) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385744 0.96 PTGER4 (0.33) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18385609 0.95 PTGER4 (0.33) KDM4EATML3MBTL1PTGER4MEN1
SCHEMBL18565911 0.95 PTGER4 (0.33) KDM4EATML3MBTL1PTGER4MEN1

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-20160329505-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, INK COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-11-10 — — US disclosed
US-20160329505-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, INK COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-11-10 — — 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-20160329505-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, INK COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE LEF1, BMI1, L1CAM KDM4E 1573/4885ATM 2985/4885L3MBTL1 399/4885

“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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