SCHEMBL18159650

SCHEMBL18159650

c1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)-c4ccccc4-c4cc(-n6c7ccccc7c7ccc(-c8ccccc8)cc76)ccc4O5)c3c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.40
▸ ATM Q13315 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ EDNRA P25101 2/20 0.38
▸ EDNRB P24530 1/20 0.38
▸ HDAC4 P56524 1/20 0.35
▸ RXRA P19793 1/20 0.34
▸ RXRB P28702 1/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ TSPO P30536 1/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ APAF1 O14727 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ PTBP1 P26599 1/20 0.33
▸ HTT P42858 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
SCHEMBL16801596 0.93 L3MBTL1 (0.35) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL16801039 0.92 EDNRA (0.40) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL18159636 0.91 L3MBTL1 (0.47) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL16801191 0.90 EDNRA (0.39) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL18159607 0.88 EDNRA (0.38) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL15242145 0.88 L3MBTL1 (0.46) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL16801462 0.88 L3MBTL1 (0.46) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL18159649 0.87 KDM4E (0.47) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL16801214 0.87 L3MBTL1 (0.47) L3MBTL1ATMKDM4EEDNRAEDNRB
SCHEMBL21226922 0.87 L3MBTL1 (0.42) L3MBTL1ATMKDM4EEDNRAEDNRB

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-11917913-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2024-02-27 — — US disclosed
US-11917913-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2024-02-27 — — US disclosed
US-20190280218-A1 SUBSTITUTED OXEPINES MERCK PATENT GMBH (DE) 2019-09-12 — — US disclosed
US-10374170-B2 Substituted oxepines MERCK PATENT GMBH (DE) 2019-08-06 — — US disclosed
US-20160308146-A1 SUBSTITUTED OXEPINES MERCK PATENT GMBH (DE) 2016-10-20 — — US disclosed
US-20160308146-A1 SUBSTITUTED OXEPINES MERCK PATENT GMBH (DE) 2016-10-20 — — 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 (4 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-11917913-B2 Substituted oxepines OXGR1, OXTR, OCIAD2 L3MBTL1 1480/4885ATM 1550/4885KDM4E 710/4885
US-10374170-B2 Substituted oxepines OXGR1, OXTR, OCIAD2 L3MBTL1 1480/4885ATM 1550/4885KDM4E 710/4885
US-20190280218-A1 SUBSTITUTED OXEPINES OXGR1, OXTR, OCIAD2 L3MBTL1 1480/4885ATM 1550/4885KDM4E 710/4885
US-20160308146-A1 SUBSTITUTED OXEPINES OXGR1, OXTR, OCIAD2 L3MBTL1 1480/4885ATM 1550/4885KDM4E 710/4885

“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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