SCHEMBL18565442

SCHEMBL18565442

Cn1c2cc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)ccc2c2c3ccccc3ccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RAB9A P51151 4/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
NPC1 O15118 2/20 0.33
MAOB P27338 1/20 0.33
NQO2 P16083 1/20 0.33
PDK2 Q15119 6/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
FLT3 P36888 1/20 0.31
MAPK1 P28482 2/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
ATM Q13315 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL18565439 0.94 RXRA (0.35) RXRARXRBRAB9AL3MBTL1NPC1
SCHEMBL18565444 0.92 NQO2 (0.33) RXRARXRBRAB9AL3MBTL1NQO2
SCHEMBL18565433 0.89 RXRA (0.36) RXRARXRBRAB9AL3MBTL1NPC1
SCHEMBL18565445 0.86 PTGES (0.33) RXRARXRBNQO2PDK2HSD17B10
SCHEMBL18565451 0.86 FLT3 (0.33) PDK2GAAFLT3MAPK1CASP1
SCHEMBL18565435 0.85 KDM4E (0.32) PDK2FLT3MAPK1KDM4EMEN1
SCHEMBL18565368 0.83 RXRA (0.48) RXRARXRBRAB9AL3MBTL1NPC1
SCHEMBL18565401 0.83 RXRA (0.37) RXRARXRBRAB9AL3MBTL1NPC1
SCHEMBL18565443 0.81 MAPT (0.33) RXRARXRBL3MBTL1NQO2PDK2
SCHEMBL22661400 0.81 RXRA (0.50) RXRARXRBRAB9AL3MBTL1NPC1

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 RXRA 4249/4885RXRB 4487/4885RAB9A 1488/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 RXRA 4249/4885RXRB 4487/4885RAB9A 1488/4885

“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.