SCHEMBL596165

SCHEMBL596165

CN(C)c1ccc(CCCO)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
TSHR P16473 3/20 0.54
MAPK1 P28482 2/20 0.54
CYP3A4 P08684 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
CHKA P35790 4/20 0.52
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 1/20 0.48
CALM1 P0DP23 2/20 0.47
CYP4A11 Q02928 2/20 0.47
CA2 P00918 1/20 0.46
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
MCL1 Q07820 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CHKB Q9Y259 1/20 0.43

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
SCHEMBL31186833 0.94 CHKA (0.55) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL25305224 0.92 CHKA (0.53) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL66152 0.86 ALDH1A1 (0.58) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL6310153 0.86 ALDH1A1 (0.64) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL4405018 0.81 ALDH1A1 (0.70) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL239040 0.81 CA2 (0.60) ALDH1A1CYP3A4TDP1ALOX15HSD17B10
SCHEMBL14902842 0.80 ALDH1A1 (0.56) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL727512 0.80 ALDH1A1 (0.56) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL14732703 0.80 MEN1 (0.49) ALDH1A1CYP3A4HSD17B10CYP4A11CA2
SCHEMBL9763681 0.79 AOC3 (0.50) ALDH1A1TSHRMAPK1CYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250107971-A1 POWDER-LIQUID-TYPE DENTAL PLATE LINER TOKUYAMA DENTAL CORPORATION (JP) 2025-04-03 US disclosed
EP-4464302-A1 POWDER-LIQUID-TYPE DENTURE BASE LINER Tokuyama Dental Corporation (JP) 2024-11-20 EP disclosed
CN-118541125-A Lining material for powder-liquid denture base 德山齿科株式会社 2024-08-23 CN disclosed
WO-2023135930-A1 POWDER-LIQUID-TYPE DENTURE BASE LINER 株式会社トクヤマデンタル 2023-07-20 WO disclosed
US-9067928-B2 Compounds and methods of use ABBVIE INC. (US) 2015-06-30 US disclosed
US-9067928-B2 Compounds and methods of use ABBVIE INC. (US) 2015-06-30 US disclosed
US-9067928-B2 Compounds and methods of use ABBVIE INC. (US) 2015-06-30 US disclosed
EP-2376085-B1 COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2014-02-26 EP disclosed
EP-2376085-B1 COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2014-02-26 EP disclosed
US-20140005190-A1 COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2014-01-02 US disclosed
US-8114893-B2 Compounds and methods of use GENENTECH, INC. (US) 2012-02-14 US disclosed
US-8114893-B2 Compounds and methods of use GENENTECH, INC. (US) 2012-02-14 US disclosed
US-8114893-B2 Compounds and methods of use GENENTECH, INC. (US) 2012-02-14 US disclosed
EP-2376085-A1 COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2011-10-19 EP disclosed
US-20100190782-A1 COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-07-29 US disclosed
US-20100190782-A1 COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-07-29 US disclosed
US-20100190782-A1 COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-07-29 US disclosed
WO-2010080478-A1 COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2010-07-15 WO disclosed
WO-2010080478-A1 COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2010-07-15 WO disclosed
US-4990505-A Treating asthma, bronchitis; adrenergic stimulants GLAXO GROUP LIMITED (GB) 1991-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250107971-A1 POWDER-LIQUID-TYPE DENTAL PLATE LINER HEATR1, HEATR6, ACTR5 ALDH1A1 2486/4885TSHR 1220/4885MAPK1 487/4885
US-20140005190-A1 COMPOUNDS AND METHODS OF USE BCL2A1, BCL2, BAX ALDH1A1 3814/4885TSHR 1965/4885MAPK1 3552/4885
US-20100190782-A1 COMPOUNDS AND METHODS OF USE BCL2A1, BCL2, BAX ALDH1A1 3814/4885TSHR 1965/4885MAPK1 3552/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.