SCHEMBL1585026

SCHEMBL1585026

CC1(C)C(=CC=C2C(=O)c3ccccc3C2=O)N2CCCc3cccc1c32

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 2/20 0.47
▸ MAPT P10636 6/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ KMT2A Q03164 5/20 0.42
▸ USP2 O75604 4/20 0.42
▸ HTT P42858 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ ALDH1A1 P00352 9/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAP2K1 Q02750 1/20 0.39
▸ LMNA P02545 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ PLIN1 O60240 1/20 0.33
▸ PLIN5 Q00G26 1/20 0.33
▸ ABHD5 Q8WTS1 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ALOX12 P18054 1/20 0.33

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
SCHEMBL1585025 1.00 CES1 (0.47) CES1MAPTMEN1KMT2AUSP2
SCHEMBL12721306 1.00 CES1 (0.47) CES1MAPTMEN1KMT2AUSP2
SCHEMBL12721269 0.94 CES1 (0.42) CES1MAPTMEN1KMT2AUSP2
SCHEMBL1585774 0.94 CES1 (0.42) CES1MAPTMEN1KMT2AUSP2
SCHEMBL13388161 0.89 CES1 (0.38) CES1MAPTMEN1KMT2AUSP2
SCHEMBL12722217 0.89 CES1 (0.38) CES1MAPTMEN1KMT2AUSP2
SCHEMBL13388162 0.89 CES1 (0.38) CES1MAPTMEN1KMT2AUSP2
SCHEMBL17023944 0.89 CES1 (0.38) CES1MAPTMEN1KMT2AUSP2
SCHEMBL30521120 0.89 CES1 (0.38) CES1MAPTMEN1KMT2AUSP2
SCHEMBL12721275 0.87 MAPT (0.39) CES1MAPTMEN1KMT2AUSP2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9368729-B2 Mixtures for producing photoactive layers for organic solar cells and organic photodetectors BASF SE (DE) 2016-06-14 — — US disclosed
EP-2489084-B1 COMPOSITIONS FOR THE PRODUCTION OF PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTO DETECTORS BASF SE (DE) 2015-12-23 — — EP disclosed
US-20120267579-A1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS BASF SE (DE) 2012-10-25 — — US disclosed
EP-2489084-A1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS BASF SE (DE) 2012-08-22 — — EP disclosed
WO-2011045253-A1 MIXTURES FOR PRODUCING PHOTOACTIVE LAYERS FOR ORGANIC SOLAR CELLS AND ORGANIC PHOTODETECTORS BASF SE (DE) 2011-04-21 — — WO disclosed
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