SCHEMBL21906628

SCHEMBL21906628

Cc1ccc(N(c2cc3c4cc(N(c5ccc(C)cc5)c5cccc6c5oc5c(C7CCCCC7)cc(-c7ccc8c(N(c9ccccc9-c9ccccc9)c9cccc%10c9oc9c(C%11CCCCC%11)cccc9%10)cc9c%10cc(N(c%11ccccc%11-c%11ccccc%11)c%11cccc%12c%11oc%11c(C%13CCCCC%13)cccc%11%12)c%11ccccc%11c%10oc9c8c7)cc56)c5ccccc5c4oc3c3ccccc23)c2cccc3c2oc2c(C4CCCCC4)cccc23)cc1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CAMKK2 Q96RR4 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
SCHEMBL16641967 0.88 PTGS2 (0.34) —
SCHEMBL21870470 0.87 CAMKK2 (0.31) CAMKK2
SCHEMBL15852228 0.86 PTGS2 (0.33) —
SCHEMBL15852229 0.86 CYP1B1 (0.32) —
SCHEMBL15852238 0.85 PDK2 (0.32) —
SCHEMBL15852237 0.85 PDK2 (0.30) —
SCHEMBL25005622 0.85 PTGDR (0.33) CAMKK2
SCHEMBL15852232 0.84 CYP1B1 (0.32) —
SCHEMBL15852239 0.84 MCL1 (0.30) CAMKK2
SCHEMBL22381176 0.82 ADORA3 (0.32) —

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-10763444-B2 Organic electroluminescence device and electronic apparatus provided with the same IDEMITSU KOSAN CO., LTD. (JP) 2020-09-01 — — US disclosed
US-20200111962-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS PROVIDED WITH THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2020-04-09 — — US disclosed
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