SCHEMBL3313611

SCHEMBL3313611

C=CCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.84

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.84
L3MBTL1 Q9Y468 1/20 0.84
HTT P42858 3/20 0.63
PKM P14618 1/20 0.62
TSHR P16473 2/20 0.57
MAPK1 P28482 2/20 0.57
USP2 O75604 1/20 0.57
ALOX15 P16050 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TP53 P04637 1/20 0.56
PLA2G4B P0C869 2/20 0.54
RARB P10826 4/20 0.51
POLB P06746 1/20 0.51
APEX1 P27695 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPT P10636 1/20 0.51
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50

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
SCHEMBL8940370 0.95 ALDH1A1 (0.77) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL4350348 0.91 ALDH1A1 (1.00) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL1871410 0.90 ALDH1A1 (0.90) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL13346213 0.88 ALDH1A1 (0.88) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL8379459 0.88 ALDH1A1 (0.88) ALDH1A1L3MBTL1HTTPKMTSHR
Hydrochloric Acid SCHEMBL8152259 0.88 ALDH1A1 (0.88) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL4353031 0.88 ALDH1A1 (0.88) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL2622416 0.88 ALDH1A1 (0.88) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL9448865 0.88 ALDH1A1 (0.88) ALDH1A1L3MBTL1HTTPKMTSHR
SCHEMBL9448804 0.88 ALDH1A1 (0.75) ALDH1A1L3MBTL1HTTPKMTSHR

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024071323-A1 COMPOSITION, OPTICALLY ANISOTROPIC LAYER, LAMINATE, METHOD FOR MANUFACTURING OPTICALLY ANISOTROPIC LAYER, AND LIQUID CRYSTAL COMPOUND 富士フイルム株式会社 2024-04-04 WO disclosed
CN-113433727-A Electrochromic optical film and preparation method thereof 珠海光驭科技有限公司 2021-09-24 CN disclosed
US-9102652-B2 Dichroic-photochromic 2H-naphtho[1,2-b]pyran compounds and devices ALPHAMICRON INCORPORATED (US) 2015-08-11 US disclosed
CN-102439520-B Photosensitive resin composition ASAHI KASEI E MATERIALS CORP 2014-08-27 CN disclosed
EP-2076504-B1 DICHROIC-PHOTOCHROMIC COMPOUNDS AND DEVICES ALPHAMICRON INC (US) 2014-05-14 EP disclosed
US-8697890-B2 Dichroic-photochromic 2H-naphtho[1,2-b]pyran compounds and devices ALPHAMICRON INCORPORATED (US) 2014-04-15 US disclosed
US-8466199-B2 Allyloxy and alkyloxy benzoic acid delivery agents EMISPHERE TECHNOLOGIES, INC. (US) 2013-06-18 US disclosed
US-8466199-B2 Allyloxy and alkyloxy benzoic acid delivery agents EMISPHERE TECHNOLOGIES, INC. (US) 2013-06-18 US disclosed
US-8466199-B2 Allyloxy and alkyloxy benzoic acid delivery agents EMISPHERE TECHNOLOGIES, INC. (US) 2013-06-18 US disclosed
US-8354147-B2 Polymerizable liquid crystal compound, composition and polymer JNC CORPORATION (JP) 2013-01-15 US disclosed
US-6107427-A Cross-linkable, photoactive polymer materials ROLIC AG (CH) 2000-08-22 US disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
EP-0783537-B1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS ROLIC AG (CH) 1999-12-01 EP disclosed
US-5965761-A CROSSLINKABLE SILANE DERIVAATIVES HAVING A 3-ARYLACRYLIC ACID OR-ACRYLAMIDE GROUP FOR ORIENTING LAYER AND FOR NONSTRUCTURED AND STRUCTURED OPTICAL ELEMENTS AND MULTILAYER SYSTEMS; PHOTOSTABILITY; CONTRAST; RESOLUTION ROLIC AG (CH) 1999-10-12 US disclosed
EP-0844248-A2 Crosslinkable, photoactive silane derivatives Rolic AG (CH) 1998-05-27 EP disclosed
CN-1181383-A Silane derivatives incorporating photoreactive groups ROLIC AG (CH) 1998-05-13 CN disclosed
EP-0783537-A1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS F. HOFFMANN-LA ROCHE AG (CH) 1997-07-16 EP disclosed
EP-0763552-A2 Curable, photoactive polymeric materials Rolic AG (CH) 1997-03-19 EP disclosed
EP-0763552-A2 Curable, photoactive polymeric materials Rolic AG (CH) 1997-03-19 EP disclosed
WO-1996010049-A1 CUMARIN AND QUINOLINONE DERIVATIVES FOR PREPARING LIQUID CRYSTAL ORIENTATION LAYERS F. HOFFMANN-LA ROCHE AG (CH) 1996-04-04 WO disclosed