SCHEMBL12134971

SCHEMBL12134971

C=C/C(=C\C=C\C)N(c1ccc(C)cc1)c1ccc(-c2cncc(-c3cncc(-c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)c3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.33

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
SCHEMBL12119783 0.85 — —
SCHEMBL20814556 0.81 TRPM8 (0.38) —
SCHEMBL13136685 0.79 KCNH2 (0.32) —
SCHEMBL23393456 0.78 HSD17B1 (0.33) —
SCHEMBL11932372 0.77 TRPM8 (0.40) —
SCHEMBL23018689 0.77 ALDH1A1 (0.31) —
SCHEMBL608779 0.76 HDAC1 (0.40) HDAC1
SCHEMBL19466009 0.74 TP53 (0.33) —
SCHEMBL24191151 0.74 TRPM8 (0.38) —
SCHEMBL14463352 0.72 PDK2 (0.41) —

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8062770-B2 Ambipolar host in organic light emitting diode NITTO DENKO CORPORATION (JP) 2011-11-22 — — US disclosed
US-8062770-B2 Ambipolar host in organic light emitting diode NITTO DENKO CORPORATION (JP) 2011-11-22 — — US disclosed
US-8003229-B2 Ambipolar host in organic light emitting diode NITTO DENKO CORPORATION (JP) 2011-08-23 — — US disclosed
US-8003229-B2 Ambipolar host in organic light emitting diode NITTO DENKO CORPORATION (JP) 2011-08-23 — — US disclosed
US-20100213831-A1 AMBIPOLAR HOST IN ORGANIC LIGHT EMITTING DIODE NITTO DENKO CORPORATION (JP) 2010-08-26 — — US disclosed
US-20100213831-A1 AMBIPOLAR HOST IN ORGANIC LIGHT EMITTING DIODE NITTO DENKO CORPORATION (JP) 2010-08-26 — — 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-20100213831-A1 AMBIPOLAR HOST IN ORGANIC LIGHT EMITTING DIODE DRD1, CHRM1, NR2E3 HDAC1 129/4885

“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