SCHEMBL13615992

SCHEMBL13615992

CN1c2ccccc2CCc2cc(-c3ccc4c5ccccc5c5c6ccccc6c6ccccc6c5c4c3)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 7/20 0.43
CYP11B2 P19099 7/20 0.43
CYP1A2 P05177 3/20 0.41
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41
HSD17B3 P37058 2/20 0.39
SCN9A Q15858 3/20 0.36
SRD5A1 P18405 1/20 0.35
ADRA2B P18089 4/20 0.35
ADRA2C P18825 4/20 0.35
HTR2A P28223 4/20 0.35
HTR2C P28335 4/20 0.35
SLC6A4 P31645 4/20 0.35
ADRA1A P35348 4/20 0.35
HRH1 P35367 4/20 0.35
HTR2B P41595 4/20 0.35
CHRM1 P11229 3/20 0.35
DRD2 P14416 3/20 0.35
CHRM3 P20309 3/20 0.35
OPRK1 P41145 3/20 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
SCHEMBL13615807 1.00 CYP11B1 (0.43) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL20905279 0.86 CYP11B1 (0.50) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL18596813 0.75 CYP11B1 (0.42) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL13615993 0.75 MEN1 (0.35) LMNAMAPTMAPK1HTTSMN1; SMN2
SCHEMBL13615813 0.75 MEN1 (0.35) LMNAMAPTMAPK1HTTSMN1; SMN2
SCHEMBL20625222 0.74 CYP11B1 (0.41) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL2604390 0.74 MAOA (0.52) CYP1A2HSD17B3SCN9AADRA2BADRA2C
SCHEMBL13408726 0.73 CYP11B1 (0.42) CYP11B1CYP11B2CYP1A2HSD17B3SCN9A
SCHEMBL20176571 0.72 HSD17B3 (0.46) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL11978694 0.72 NOTUM (0.44) CYP1A2HSD17B3SCN9ASRD5A1ADRA2B

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-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 US disclosed
US-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 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-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 CYP11B1 382/4885CYP11B2 470/4885CYP1A2 426/4885

“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.