Sugi Predict

Sugi Predict / Compounds / SCHEMBL18744349

SCHEMBL18744349

SCHEMBL18744349

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4cc5ccc6cc(-c7ccc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)cc7)cc7c6c5c(c4)n7-c4ccccc4)cc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 15/20 0.36
▸ PGR P06401 2/20 0.35
▸ LPL P06858 1/20 0.32
▸ LIPG Q9Y5X9 1/20 0.32
▸ AVPR1A P37288 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
SCHEMBL18744374 0.99 PDK2 (0.39) PDK2PGRLPLLIPGAVPR1A
SCHEMBL18744348 0.99 PGR (0.35) PDK2PGR
SCHEMBL16021503 0.93 PDK2 (0.33) PDK2PGRLPLLIPG
SCHEMBL16021480 0.93 PDK2 (0.33) PDK2PGRLPLLIPG
SCHEMBL16021438 0.92 PDK2 (0.34) PDK2PGRLPLLIPG
SCHEMBL16021486 0.90 PDK2 (0.34) PDK2LPLLIPG
SCHEMBL15678302 0.87 — —
SCHEMBL15706198 0.86 PDK2 (0.31) PDK2
SCHEMBL16021442 0.85 PDK2 (0.40) PDK2PGR
SCHEMBL15978793 0.85 ESR1 (0.43) —

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-9627624-B2 Compound for organic optoelectronic device organic light emitting diode including the same and display including the organic light emitting diode SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-18 — — US disclosed
US-9627624-B2 Compound for organic optoelectronic device organic light emitting diode including the same and display including the organic light emitting diode SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-18 — — US disclosed
Send feedback