SCHEMBL19033212

SCHEMBL19033212

Cc1ccc(-c2ccc(C(C)(C)C)c3nsnc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ENPP1 P22413 1/20 0.33
▸ COMT P21964 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ PDE3B Q13370 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL25475487 0.87 KIF11 (0.39) LMNATSHRKMT2AALDH1A1SMN1; SMN2
SCHEMBL862821 0.86 COMT (0.40) LMNATSHRMAPTMEN1USP2
SCHEMBL20806202 0.84 COMT (0.39) LMNATSHRMAPTMEN1USP2
SCHEMBL14682708 0.84 MAPT (0.32) MAPTMEN1KMT2A
SCHEMBL19034482 0.80 RXRA (0.42) GAA
SCHEMBL12157078 0.80 MAPT (0.37) LMNATSHRMAPTMEN1KMT2A
SCHEMBL13958188 0.79 LMNA (0.42) LMNATSHRMAPTMEN1USP2
SCHEMBL18464326 0.77 NPC1 (0.43) LMNATSHRMAPTMEN1USP2
SCHEMBL18040333 0.77 KIF11 (0.45) LMNATSHRKMT2AALDH1A1SMN1; SMN2
SCHEMBL14685681 0.74 MAPT (0.41) LMNATSHRMAPTMEN1GAA

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-9691555-B2 Photosensitive porphyrin dyes for dye-sensitized solar cells NATIONAL CHUNG HSING UNIVERSITY (TW) 2017-06-27 — — US disclosed
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