SCHEMBL12259331

SCHEMBL12259331

c1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)Oc1ccc(-n3c4ccccc4c4ccccc43)cc1S2

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ EDNRB P24530 1/20 0.36
▸ EDNRA P25101 1/20 0.36
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL18199805 0.90 KDM4E (0.42) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL18199804 0.89 KDM4E (0.39) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL2389888 0.81 KDM4E (0.52) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL2388968 0.81 KDM4E (0.52) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL12259308 0.81 KDM4E (0.52) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21032526 0.77 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL18199797 0.76 L3MBTL1 (0.49) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL18199786 0.76 KIF11 (0.35) L3MBTL1NPC1RAB9A
SCHEMBL18199816 0.76 L3MBTL1 (0.45) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21578645 0.75 ATM (0.38) KDM4EATML3MBTL1EDNRBEDNRA

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-8012606-B2 Heterocyclic compound and organic electroluminescent device using the same NIPPON STEEL CHEMICAL CO., LTD. (JP) 2011-09-06 — — US disclosed
US-8012606-B2 Heterocyclic compound and organic electroluminescent device using the same NIPPON STEEL CHEMICAL CO., LTD. (JP) 2011-09-06 — — US disclosed
US-20090153031-A1 Heterocyclic compound and organic electroluminescent device using the same NIPPON STEEL CHEMICAL CO., LTD (JP) 2009-06-18 — — US disclosed
US-20090153031-A1 Heterocyclic compound and organic electroluminescent device using the same NIPPON STEEL CHEMICAL CO., LTD (JP) 2009-06-18 — — 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-20090153031-A1 Heterocyclic compound and organic electroluminescent device using the same ORC3, NAP1L4, NR4A2 KDM4E 1619/4885ATM 3596/4885L3MBTL1 1984/4885

“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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