SCHEMBL13507299

SCHEMBL13507299

CN1c2cc(-c3cccnc3)ccc2-c2cc3c(c4cccc1c24)c1ccc(-c2cccnc2)cc1n3C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 6/20 0.38
▸ CYP11B1 P15538 5/20 0.38
▸ CYP17A1 P05093 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP19A1 P11511 1/20 0.38
▸ CHEK1 O14757 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ GRM2 Q14416 1/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ PRMT6 Q96LA8 1/20 0.35
▸ PIK3CA P42336 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
SCHEMBL13507350 0.87 RXRA (0.40) CHEK1MAOAGRM2
SCHEMBL13507849 0.84 L3MBTL1 (0.33) MAOA
SCHEMBL13507361 0.83 RXRA (0.34) CHEK1
SCHEMBL13507370 0.82 L3MBTL1 (0.33) —
SCHEMBL13507096 0.82 RXRA (0.37) CHEK1GRM2
SCHEMBL13507870 0.81 RXRA (0.40) —
SCHEMBL13507271 0.81 CHEK1 (0.34) CHEK1
SCHEMBL13507356 0.81 AKT1 (0.38) CHEK1HTR1D
SCHEMBL13507859 0.81 IRAK4 (0.35) BACE1METAP2
SCHEMBL13507273 0.81 AKT1 (0.38) CHEK1HTR1D

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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 — — US disclosed
US-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 — — 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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 CYP11B2 781/4885CYP11B1 720/4885CYP17A1 1529/4885

“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