SCHEMBL19686129

SCHEMBL19686129

O=C1CCCc2cc(-n3c4ccc(N(c5ccccc5)c5ccccc5)cc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.42
MAOA P21397 5/20 0.39
MAOB P27338 5/20 0.39
CYP2A6 P11509 1/20 0.39
PRKCI P41743 1/20 0.39
HSD17B1 P14061 2/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
BAZ2B Q9UIF8 1/20 0.34
APP P05067 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK14 Q16539 4/20 0.33
HIF1A Q16665 1/20 0.33
PGR P06401 1/20 0.32

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
SCHEMBL19685700 0.91 MAOA (0.39) GRM5MAOAMAOBCYP2A6PRKCI
SCHEMBL19686258 0.84 ALDH1A1 (0.38) LMNAAPPALDH1A1
SCHEMBL19685906 0.83 MAOA (0.45) GRM5MAOAMAOBCYP2A6PRKCI
SCHEMBL32691764 0.82 GRM5 (0.55) GRM5MAOAMAOBCYP2A6PRKCI
SCHEMBL19685908 0.82 GRM5 (0.55) GRM5MAOAMAOBCYP2A6PRKCI
SCHEMBL19685907 0.82 HSD17B1 (0.50) GRM5MAOAMAOBCYP2A6PRKCI
SCHEMBL19685743 0.81 ALDH1A1 (0.51) MAOAMAOBLMNAAPPALDH1A1
SCHEMBL19685771 0.78 APP (0.35) GRM5LMNASMN1; SMN2APPMEN1
SCHEMBL19686167 0.77 APP (0.33) MAOAMAOBLMNAAPPALDH1A1
SCHEMBL9913013 0.76 L3MBTL1 (0.45) LMNASMN1; SMN2APPMEN1ALDH1A1

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-10714693-B2 Polycyclic compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-14 US disclosed
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2017-12-07 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-10714693-B2 Polycyclic compound and organic electroluminescence device including the same CYC1, CCNA1, CYCS GRM5 4529/4885MAOA 1632/4885MAOB 1878/4885
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME CYC1, CCNA1, CYCS GRM5 4529/4885MAOA 1632/4885MAOB 1878/4885

“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.