SCHEMBL29961399

SCHEMBL29961399

CC(C)(C)c1cc(N(c2ccccc2)c2cc(Cl)c3oc4ccccc4c3c2)cc(C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 6/20 0.43
▸ TTR P02766 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TNKS O95271 1/20 0.30
▸ CDC14B O60729 1/20 0.30
▸ CDC14A Q9UNH5 1/20 0.30
▸ DYRK1A Q13627 1/20 0.30

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
SCHEMBL29961331 0.94 AHR (0.43) AHRTTRSMN1; SMN2TNKS
SCHEMBL26404921 0.90 AHR (0.46) AHRTTRSMN1; SMN2TNKS
SCHEMBL29961879 0.85 AHR (0.39) AHRTTRSMN1; SMN2TNKS
SCHEMBL24561687 0.80 AHR (0.49) AHRTTRSMN1; SMN2TNKS
SCHEMBL21936967 0.80 AHR (0.49) AHRTTRSMN1; SMN2TNKS
SCHEMBL26404785 0.80 AHR (0.33) AHRTTR
SCHEMBL29961175 0.77 KIF11 (0.37) —
SCHEMBL21333943 0.76 CYP2D6 (0.42) SMN1; SMN2
SCHEMBL14763816 0.76 CYP2D6 (0.42) SMN1; SMN2
SCHEMBL15746012 0.75 MEN1 (0.41) AHRSMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022223846-A1 ORAGNIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2022-10-27 — — WO disclosed
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