SCHEMBL17209133

SCHEMBL17209133

CC1(C)c2ccccc2-c2ccc(-n3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc43)cc21

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL17209185 0.95 CYP11B1 (0.31) CYP11B1
SCHEMBL17209300 0.95 CYP11B1 (0.31) CYP11B1
SCHEMBL17209203 0.95 CYP11B1 (0.33) CYP11B1
SCHEMBL17209223 0.92 NTSR1 (0.33) CYP11B1ALDH1A1HPGDTSHRMAPK1
SCHEMBL17209178 0.92 NTSR1 (0.33) CYP11B1ALDH1A1HPGDTSHRMAPK1
SCHEMBL17209254 0.92 CYP11B1 (0.32) CYP11B1
SCHEMBL17209204 0.92 CYP11B1 (0.32) CYP11B1
SCHEMBL17209311 0.91 CYP11B1 (0.33) CYP11B1ALDH1A1HPGD
SCHEMBL17209201 0.91 CYP11B1 (0.33) CYP11B1ALDH1A1HPGD
SCHEMBL17209289 0.91 CYP11B1 (0.33) CYP11B1ALDH1A1HPGD

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
WO-2016043394-A1 LIGHT EMITTING DIODE AND ELECTRONIC DEVICE COMPRISING SAME 주식회사 엘엠에스 2016-03-24 — — WO disclosed
WO-2015163584-A1 NOVEL COMPOUND AND LIGHT EMITTING ELEMENT COMPRISING SAME 주식회사 엘엠에스 2015-10-29 — — WO disclosed
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