SCHEMBL26443130

SCHEMBL26443130

Cc1ccc(N(c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(C)ccc3-4)cc2)c2ccc(-c3ccc4c5ccccc5n(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c4c3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.37
▸ PGR P06401 1/20 0.33
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 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
SCHEMBL26443134 0.94 PDK2 (0.37) PDK2PGRAKR1C4AKR1C3AKR1C2
SCHEMBL26443195 0.94 PDK2 (0.35) PDK2PGRAKR1C4AKR1C3AKR1C2
SCHEMBL26443167 0.94 PDK2 (0.35) PDK2PGRAKR1C4AKR1C3AKR1C2
SCHEMBL26443214 0.94 PDK2 (0.35) PDK2PGR
SCHEMBL26443186 0.92 AKR1C4 (0.35) PDK2PGRAKR1C4AKR1C3AKR1C2
SCHEMBL26443162 0.92 AKR1C4 (0.35) PDK2PGRAKR1C4AKR1C3AKR1C2
SCHEMBL26443181 0.91 PDK2 (0.33) PDK2PGR
SCHEMBL26443206 0.91 PDK2 (0.33) PDK2PGR
SCHEMBL24496610 0.91 PDK2 (0.37) PDK2PGRAKR1C4AKR1C3AKR1C2
SCHEMBL26443177 0.90 ALDH1A1 (0.33) PDK2PGRAKR1C4AKR1C3AKR1C2

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
US-20230126748-A1 POLYMER, A COMPOSITION, AND AN ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-04-27 — — US disclosed
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