SCHEMBL18564005

SCHEMBL18564005

Cn1c2ccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)cc2c2ccc3ccccc3c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 1/20 0.46
ALKBH5 Q6P6C2 1/20 0.40
FTO Q9C0B1 1/20 0.40
PGR P06401 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 2/20 0.38
PTGER4 P35408 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GPR3 P46089 1/20 0.38
RXFP1 Q9HBX9 2/20 0.37
HSP90AA1 P07900 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL21030561 1.00 KDM4E (0.46) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL18566104 0.97 KDM4E (0.44) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL18563993 0.94 KDM4E (0.45) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL21030553 0.92 KDM4E (0.42) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL18563998 0.91 KDM4E (0.43) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL21030563 0.90 RXRA (0.45) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL17298652 0.89 L3MBTL1 (0.51) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL25847238 0.88 RXRA (0.43) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL22661271 0.87 RXRA (0.48) KDM4EL3MBTL1ATMALKBH5FTO
SCHEMBL23348108 0.86 MAOB (0.46) KDM4EL3MBTL1ALKBH5FTORXRA

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-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 (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-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 KDM4E 225/4885L3MBTL1 1263/4885ATM 3092/4885

“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.