SCHEMBL18370791

SCHEMBL18370791

c1ccc(-c2ccc(-c3cccc(-c4cccc(-c5nc(-c6cccc(-c7cc(-c8ccccc8)cc(-c8ccccc8)c7)c6)c6c(n5)sc5ccccc56)c4)c3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 7/20 0.38
▸ ADORA1 P30542 6/20 0.38
▸ PIK3CA P42336 1/20 0.35
▸ PI4KA P42356 1/20 0.35
▸ PI4KB Q9UBF8 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ HPGD P15428 2/20 0.34
▸ ELANE P08246 1/20 0.34
▸ GP6 Q9HCN6 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ LIMK1 P53667 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
SCHEMBL18370829 1.00 ADORA2A (0.38) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370854 1.00 ADORA2A (0.38) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370839 1.00 ADORA2A (0.38) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370832 1.00 ADORA2A (0.38) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370847 1.00 ADORA2A (0.38) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370762 0.99 ADORA2A (0.39) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370837 0.99 ADORA2A (0.39) ADORA2AADORA1MEN1KMT2AHPGD
SCHEMBL18370771 0.99 ADORA2A (0.39) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370782 0.99 ADORA2A (0.39) ADORA2AADORA1PIK3CAPI4KAPI4KB
SCHEMBL18370800 0.99 ADORA2A (0.39) ADORA2AADORA1PIK3CAPI4KAPI4KB

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-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2017-01-12 — — US disclosed
US-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2017-01-12 — — 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-20170012216-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 ADORA2A 4711/4885ADORA1 4810/4885PIK3CA 3965/4885

“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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