SCHEMBL18564307

SCHEMBL18564307

CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccc(-c2nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)c3)nc(-c3cccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(C)C)c3)n2)c1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.33
RXFP1 Q9HBX9 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ADORA2A P29274 1/20 0.30
PDE10A Q9Y233 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
SCHEMBL24217426 0.98 RXFP1 (0.33) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL25966451 0.97 KDM4E (0.34) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL25965717 0.96 RXFP1 (0.32) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL18564372 0.96 RXFP1 (0.32) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL18564388 0.96 RXFP1 (0.32) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL25966550 0.95 KDM4E (0.33) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL25965772 0.95 PDE10A (0.33) PGRRXFP1KDM4EATML3MBTL1
SCHEMBL25965810 0.94 RXFP1 (0.31) RXFP1
SCHEMBL25966456 0.94 KDM4E (0.32) RXFP1KDM4EATML3MBTL1
SCHEMBL25966454 0.94 KDM4E (0.35) RXFP1KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-05-14 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 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 (2 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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device EED, BMI1, CD99 PGR 1092/4885RXFP1 4854/4885KDM4E 225/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 PGR 1092/4885RXFP1 4854/4885KDM4E 225/4885

“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.