SCHEMBL24039773

SCHEMBL24039773

c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6ccccc6)cc(-c6ccccn6)c5)ccc43)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.44
NPY5R Q15761 1/20 0.41
HTR1A P08908 1/20 0.41
HTR7 P34969 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MCL1 Q07820 2/20 0.36
DHODH Q02127 1/20 0.35
TSPO P30536 1/20 0.35

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
SCHEMBL14733874 0.93 HTR1A (0.45) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL16901210 0.92 GRM5 (0.45) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL25671789 0.92 GRM5 (0.45) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL16902187 0.91 KDM4E (0.46) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL19271516 0.91 GRM5 (0.45) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL13471431 0.90 KDM4E (0.47) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL14733832 0.90 HTR1A (0.44) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL18958771 0.90 GRM5 (0.38) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL17349370 0.90 GRM5 (0.38) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL11965545 0.89 GRM5 (0.46) GRM5HTR1AHTR7KDM4E

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-11183641-B2 Composition for an organic electronic device and organic electronic device using the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2021-11-23 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-11183641-B2 Composition for an organic electronic device and organic electronic device using the same ORC3, ZYX, ESR1 GRM5 4265/4885NPY5R 1896/4885HTR1A 3202/4885

“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.