SCHEMBL13616015

SCHEMBL13616015

c1ccc(-c2ccc3c4ccc(-c5cc6ccccc6s5)cc4c4c5ccccc5c5ccccc5c4c3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 1/20 0.52
▸ HSD17B2 P37059 1/20 0.52
▸ APP P05067 2/20 0.50
▸ ERN1 O75460 2/20 0.45
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ NQO1 P15559 1/20 0.44
▸ NQO2 P16083 1/20 0.44
▸ ESR1 P03372 2/20 0.42
▸ ESR2 Q92731 2/20 0.42
▸ HDAC2 Q92769 1/20 0.41
▸ CYP1A1 P04798 2/20 0.41
▸ CYP1B1 Q16678 2/20 0.41
▸ F9 P00740 2/20 0.38
▸ ACLY P53396 2/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TP53 P04637 1/20 0.37

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
SCHEMBL13615832 0.94 APP (0.56) HSD17B1HSD17B2APPERN1CA1
SCHEMBL13615886 0.91 APP (0.59) HSD17B1HSD17B2APPERN1CA1
SCHEMBL26535753 0.86 HSD17B1 (0.65) HSD17B1HSD17B2APPERN1CA1
SCHEMBL13129267 0.86 APP (0.61) HSD17B1HSD17B2APPERN1CA1
SCHEMBL24368513 0.82 APP (0.50) HSD17B1HSD17B2APPERN1CA1
SCHEMBL16437977 0.82 APP (0.50) HSD17B1HSD17B2APPERN1CA1
SCHEMBL12405266 0.81 APP (0.59) HSD17B1HSD17B2APPERN1CA1
SCHEMBL30340807 0.81 HSD17B1 (0.75) HSD17B1HSD17B2APPERN1CA1
SCHEMBL5768436 0.81 APP (0.72) HSD17B1HSD17B2APPERN1CA1
SCHEMBL13615872 0.79 APP (0.49) APPNPC1ALDH1A1TP53MAPT

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 HSD17B1 655/4885HSD17B2 936/4885APP 1703/4885

“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.

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