SCHEMBL5072509

SCHEMBL5072509

C=Cc1ccccc1CCc1ccccc1CCc1ccccc1C=C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.46
▸ TSHR P16473 1/20 0.36
▸ MITF O75030 1/20 0.35
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTR2A P28223 1/20 0.31
▸ GABRA1 P14867 1/20 0.30
▸ GABRB2 P47870 1/20 0.30
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP1B1 Q16678 1/20 0.30
▸ TAAR1 Q96RJ0 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
SCHEMBL595200 0.97 ALDH1A1 (0.48) ALDH1A1TSHRMITFMEN1LMNA
SCHEMBL29377653 0.97 ALDH1A1 (0.48) ALDH1A1TSHRMITFMEN1LMNA
SCHEMBL5663675 0.89 ALDH1A1 (0.41) ALDH1A1TSHRMITFMAPT
SCHEMBL6284419 0.88 ALDH1A1 (0.44) ALDH1A1TSHRMITFMEN1LMNA
SCHEMBL31054112 0.88 ALDH1A1 (0.44) ALDH1A1TSHRMITFMEN1LMNA
SCHEMBL6278153 0.88 ALDH1A1 (0.44) ALDH1A1TSHRMITFMEN1LMNA
SCHEMBL5073359 0.87 MAPT (0.45) ALDH1A1TDP1MAPTHTR2ATAAR1
SCHEMBL6280633 0.86 ALDH1A1 (0.43) ALDH1A1TSHRMITFTHRBTDP1
SCHEMBL6281460 0.86 ALDH1A1 (0.43) ALDH1A1TSHRMITFTHRBTDP1
SCHEMBL6278393 0.86 ALDH1A1 (0.43) ALDH1A1TSHRMITFTHRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966290-A2 POROUS MONOLITHIC ORGANIC COPOLYMER FOR BIOPOLYMER CHROMATOGRAPHY Leopold-Franzens-Universität Innsbruck (AT) 2008-09-10 — — EP disclosed
WO-2007073865-A2 POROUS MONOLITHIC ORGANIC COPOLYMER FOR BIOPOLYMER CHROMATOGRAPHY LEOPOLD-FRANZENS-UNIVERSITÄT INNSBRUCK (AT) 2007-07-05 — — WO disclosed
US-20070144972-A1 Monolithic Organic Copolymer for Biopolymer Chromatography LEOPOLD-FRANZENS-UNIVERSITAT INNSBRUCK (AT) 2007-06-28 — — US disclosed
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