SCHEMBL13333986

SCHEMBL13333986

CC1(C)c2ccccc2-c2ccc(-c3c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4c(-c4ccc(-c5cccc6ccccc56)cc4)c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc34)cc21

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.32
▸ ACMSD Q8TDX5 1/20 0.32
▸ ENPP3 O14638 1/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ PPARG P37231 5/20 0.31
▸ PPARA Q07869 5/20 0.31
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ PPARD Q03181 1/20 0.30
▸ SIGMAR1 Q99720 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
SCHEMBL12014685 0.96 SIGMAR1 (0.32) SIGMAR1
SCHEMBL13766286 0.95 SIGMAR1 (0.32) SIGMAR1
SCHEMBL13333913 0.94 PDK2 (0.31) SIGMAR1
SCHEMBL13333763 0.94 PDK2 (0.31) SIGMAR1
SCHEMBL13615758 0.93 PDK2 (0.31) SIGMAR1
SCHEMBL15002932 0.93 ENPP1 (0.33) MCL1ACMSDENPP3ENPP1PPARG
SCHEMBL10153150 0.93 SIGMAR1 (0.34) SIGMAR1
SCHEMBL13333598 0.92 PIM1 (0.30) SIGMAR1
SCHEMBL12770689 0.92 DHFR (0.31) SIGMAR1
SCHEMBL13333761 0.90 — —

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
EP-2194110-A1 Electroluminescent device using electroluminescent compounds Gracel Display Inc. (KR) 2010-06-09 — — EP disclosed
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