SCHEMBL17011124

SCHEMBL17011124

Brc1ccc(/C=C/c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ ATM Q13315 1/20 0.53
▸ KMT2A Q03164 4/20 0.41
▸ POLB P06746 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ VCP P55072 1/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.38
▸ GAA P10253 1/20 0.37
▸ HDAC1 Q13547 3/20 0.36
▸ HDAC2 Q92769 3/20 0.36
▸ HDAC10 Q969S8 3/20 0.36
▸ HDAC11 Q96DB2 3/20 0.36
▸ HDAC8 Q9BY41 3/20 0.36
▸ HDAC6 Q9UBN7 3/20 0.36
▸ TP53 P04637 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ BCHE P06276 1/20 0.36

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
SCHEMBL19253337 1.00 KDM4E (0.53) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL10708650 0.91 KDM4E (0.60) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL10708645 0.91 KDM4E (0.60) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL13157274 0.91 KDM4E (0.60) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL27953870 0.91 KDM4E (0.64) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL2446031 0.88 KDM4E (0.56) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL274432 0.88 KDM4E (0.53) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL274407 0.88 KDM4E (0.53) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL274408 0.88 KDM4E (0.53) KDM4EL3MBTL1ATMKMT2APOLB
SCHEMBL17879400 0.87 L3MBTL1 (0.55) KDM4EL3MBTL1ATMKMT2APOLB

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
CN-107098818-A Aromatic compound and organic light emitting diode comprising same 郑建鸿 2017-08-29 — — CN disclosed
US-20170244034-A1 AROMATIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2017-08-24 — — US disclosed
US-20170244034-A1 AROMATIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2017-08-24 — — US disclosed
US-20170244034-A1 AROMATIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME NATIONAL TSING HUA UNIVERSITY (TW) 2017-08-24 — — US disclosed
US-9112158-B1 Asymmetric styrene derivatives having carbazole and aniline and organic light emitting diode using the same NATIONAL TSING HUA UNIVERSITY (TW) 2015-08-18 — — US disclosed
US-9112158-B1 Asymmetric styrene derivatives having carbazole and aniline and organic light emitting diode using the same NATIONAL TSING HUA UNIVERSITY (TW) 2015-08-18 — — 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-20170244034-A1 AROMATIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME ARNT, AHR, CYP1A1 KDM4E 2815/4885L3MBTL1 815/4885ATM 1017/4885

“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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