SCHEMBL13820487

SCHEMBL13820487

c1ccc(-c2c(N(c3ccccc3)c3ccccc3)c3ccccc3c3cc4c(-c5ccc6c(c5)oc5ccccc56)c5ccccc5c(-c5ccc6c(c5)oc5ccccc56)c4cc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ HPGD P15428 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MMP12 P39900 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ PLA2G2A P14555 2/20 0.32
▸ PLA2G4A P47712 2/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ MAOA P21397 2/20 0.32
▸ TTR P02766 1/20 0.32
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ GABRP O00591 1/20 0.31

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
SCHEMBL22671248 0.86 AHR (0.39) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22671243 0.86 AHR (0.39) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22670684 0.86 AHR (0.39) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22671069 0.86 AHR (0.39) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22671791 0.84 MMP12 (0.38) AHRMEN1KMT2AMAPTHPGD
SCHEMBL22670810 0.84 MMP12 (0.38) AHRMEN1KMT2AMAPTHPGD
SCHEMBL13820484 0.84 ESR1 (0.33) —
SCHEMBL13820476 0.84 ACHE (0.34) MAPTKDM4EALDH1A1TP53CYP3A4
SCHEMBL22254349 0.83 ESR1 (0.31) AHRMEN1KMT2AMAPTHPGD
SCHEMBL18904981 0.81 AHR (0.52) AHRMEN1KMT2AMAPTHPGD

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-20120286251-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2012-11-15 — — US disclosed
US-20120286251-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2012-11-15 — — 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-20120286251-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, LEF1, OR51E2 AHR 1470/4885MEN1 121/4885KMT2A 1307/4885

“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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