SCHEMBL21157087

SCHEMBL21157087

c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4cc(-c5ccccc5)cc5c6cc(-c7ccccc7)cc(-c7cccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)c7)c6n(-c6ccccc6)c45)c3)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ MGLL Q99685 1/20 0.39
▸ AVPR1A P37288 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ HTR7 P34969 1/20 0.37
▸ OPRD1 P41143 2/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ GRM5 P41594 1/20 0.35
▸ MAP3K8 P41279 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.34
▸ ALK Q9UM73 1/20 0.34
▸ MAOA P21397 1/20 0.34

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
SCHEMBL21157830 0.91 AVPR1A (0.42) HSP90AA1HTTATMAVPR1ANPC1
SCHEMBL12447535 0.91 NPC1 (0.41) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL21157083 0.89 AVPR1A (0.36) ALDH1A1AVPR1AKMT2A
SCHEMBL21157826 0.89 TSHR (0.36) AVPR1ANPC1RAB9AKMT2A
SCHEMBL17178060 0.88 L3MBTL1 (0.47) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL21156634 0.88 AVPR1A (0.36) ALDH1A1AVPR1AKMT2A
SCHEMBL21156620 0.87 NPC1 (0.43) ALDH1A1AVPR1ANPC1RAB9AKMT2A
SCHEMBL17885104 0.87 MEN1 (0.37) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL21156618 0.86 PDE10A (0.40) FAAHALDH1A1HSP90AA1PKMHTT
SCHEMBL18419080 0.86 ATM (0.37) FAAHALDH1A1HSP90AA1PKMHTT

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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-07-11 — — 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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE TEAD2, TEAD3, TEAD1 FAAH 3254/4885ALDH1A1 1545/4885HSP90AA1 1159/4885

“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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