SCHEMBL12862829

SCHEMBL12862829

C=C/C=C\C(=C)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.48
▸ GAA P10253 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NOX1 Q9Y5S8 1/20 0.43
▸ ALDH1A1 P00352 4/20 0.41
▸ TAS2R38 P59533 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ EPHX1 P07099 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ CDK9 P50750 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAOB P27338 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41

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
SCHEMBL25452834 0.82 SMN1; SMN2 (0.52) TGM2GAAMEN1KMT2ANPC1
SCHEMBL21944495 0.80 MAOB (0.42) TGM2GAAMEN1KMT2ANPC1
SCHEMBL24278379 0.80 MDM2 (0.45) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL19057796 0.79 TGM2 (0.44) TGM2GAAMEN1KMT2ANPC1
SCHEMBL19060083 0.79 TGM2 (0.44) TGM2GAAMEN1KMT2ANPC1
SCHEMBL18820910 0.78 TGM2 (0.61) TGM2GAAMEN1KMT2ANPC1
SCHEMBL17461553 0.77 TGM2 (0.47) TGM2GAAMEN1KMT2ANPC1
SCHEMBL14016448 0.77 TGM2 (0.45) TGM2GAAMEN1KMT2ANPC1
SCHEMBL22700707 0.76 TGM2 (0.46) TGM2GAAMEN1KMT2ANPC1
SCHEMBL25095136 0.76 TGM2 (0.42) TGM2GAAMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220216406-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2022-07-07 — — US disclosed
WO-2021238623-A1 ONCN QUADRIDENTATE LIGAND-CONTAINING PLATINUM COMPLEX AND APPLICATION THEREOF IN ORGANIC LIGHT-EMITTING DIODE 广东阿格蕾雅光电材料有限公司 2021-12-02 — — WO disclosed
WO-2015105315-A1 FUSED-RING COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 삼성에스디아이 주식회사 2015-07-16 — — WO disclosed
EP-1786886-B1 ANTHRACENE DERIVATIVES AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME AS A LIGHT EMITTING MATERIAL LG CHEMICAL LTD (KR) 2011-02-23 — — EP 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-20220216406-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SLCO2A1, SLCO4C1, SLC25A21 TGM2 1887/4885GAA 1913/4885MEN1 1807/4885

“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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