SCHEMBL25791076

SCHEMBL25791076

CC1(C)c2ccccc2-c2ccc(-c3cc4c5ccccc5c(-c5ccc(N(c6cccc7ccccc67)c6cccc7ccccc67)cc5)cc4c4ccccc34)cc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.33
▸ ENPP3 O14638 1/20 0.31
▸ ENPP1 P22413 1/20 0.31
▸ SIGMAR1 Q99720 2/20 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
SCHEMBL25791407 0.95 PDK2 (0.33) PDK2SIGMAR1
SCHEMBL25791188 0.93 SIGMAR1 (0.31) SIGMAR1
SCHEMBL25791594 0.92 PDK2 (0.31) PDK2
SCHEMBL25791518 0.89 MCL1 (0.31) —
SCHEMBL13725279 0.88 PDK2 (0.32) PDK2ENPP3ENPP1SIGMAR1
SCHEMBL10034387 0.88 CA12 (0.31) PDK2
SCHEMBL26283290 0.88 PDK2 (0.31) PDK2
SCHEMBL25791484 0.88 GSTP1 (0.32) SIGMAR1
SCHEMBL13726147 0.87 RXRA (0.33) PDK2ENPP3ENPP1SIGMAR1
SCHEMBL19152690 0.87 PDK2 (0.34) PDK2SIGMAR1

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-20230212334-A1 POLYMER, ELECTROLUMINESCENCE MATERIAL, ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2023-07-06 — — US disclosed
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