SCHEMBL8736101

SCHEMBL8736101

CC1(C)c2ccccc2-c2ccc(-c3cc(-c4cc(-n5c6ccccc6c6cc(-c7ccncc7)ccc65)cc(-n5c6ccccc6c6cc(-c7ccncc7)ccc65)c4)nc(-c4ccccc4)n3)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.36
▸ MKNK1 Q9BUB5 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ IMPDH2 P12268 1/20 0.31
▸ MAPT P10636 5/20 0.31
▸ MEN1 O00255 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ RECQL P46063 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ TSHR P16473 2/20 0.30
▸ DHODH Q02127 1/20 0.30
▸ HSP90AA1 P07900 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ TSPO P30536 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
SCHEMBL8734578 0.96 PDK2 (0.36) PDK2MKNK1PIK3CAIMPDH2MAPT
SCHEMBL8734564 0.95 NPY5R (0.33) PDK2MAPTMEN1KMT2AALDH1A1
SCHEMBL8736530 0.94 PDK2 (0.37) PDK2MKNK1PIK3CAMAPTMEN1
SCHEMBL8735767 0.94 PDK2 (0.36) PDK2IMPDH2MAPTMEN1KMT2A
SCHEMBL8735809 0.94 PDK2 (0.36) PDK2IMPDH2MAPTMEN1KMT2A
SCHEMBL8734567 0.92 PDK2 (0.33) PDK2MAPTMEN1KMT2AALDH1A1
SCHEMBL8737513 0.92 MEN1 (0.34) PDK2MAPTMEN1KMT2AALDH1A1
SCHEMBL18385487 0.91 MEN1 (0.32) PDK2MAPTMEN1KMT2AALDH1A1
SCHEMBL18385476 0.91 MEN1 (0.32) PDK2MAPTMEN1KMT2AALDH1A1
SCHEMBL18385474 0.91 MEN1 (0.32) PDK2MAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9266851-B2 Fluorene-containing aromatic compound, material for organic electroluminescent element, and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2016-02-23 — — US disclosed
US-9266851-B2 Fluorene-containing aromatic compound, material for organic electroluminescent element, and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2016-02-23 — — US disclosed
US-20120126217-A1 FLUORENE-CONTAINING AROMATIC COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO. LTD. (JP) 2012-05-24 — — US disclosed
US-20120126217-A1 FLUORENE-CONTAINING AROMATIC COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO. LTD. (JP) 2012-05-24 — — 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-20120126217-A1 FLUORENE-CONTAINING AROMATIC COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME NR0B2, AFF2, AFF1 PDK2 3249/4885MKNK1 4184/4885PIK3CA 4065/4885

“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.

Send feedback