SCHEMBL632575

SCHEMBL632575

CC(N)Cc1cc(O)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.54
HTR1D P28221 1/20 0.54
HTR1B P28222 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
HTR2B P41595 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
NFKB1 P19838 1/20 0.54
CYP2C19 P33261 1/20 0.54
TAAR1 Q96RJ0 3/20 0.53
SLC6A2 P23975 1/20 0.53
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
BLM P54132 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
Bromide SCHEMBL11674306 0.98 TAAR1 (0.55) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL3138811 0.84 TYR (0.55) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL14478262 0.84 TYR (0.55) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL5877825 0.83 GABRA1 (0.68) HTR2AHTR2BCYP1A2CYP2D6CYP2C9
SCHEMBL17774724 0.82 PRKCI (0.55) TAAR1SLC6A2GABRA1GABRB2
SCHEMBL14478234 0.82 AMY1A (0.52) HTR2BTAAR1SLC6A2GABRA1GABRB2
SCHEMBL18867919 0.81 HTR2A (0.51) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL11673857 0.81 HTR2A (0.42) HTR1AHTR1DHTR1BHTR2AHTR2C
SCHEMBL9169831 0.80 GABRA1 (0.48) HTR2AHTR2BCYP1A2CYP2D6CYP2C9
SCHEMBL5694325 0.80 GABRA1 (0.48) HTR2AHTR2BCYP1A2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1866357-B1 (METH)ACRYLOYL GROUP-CONTAINING AROMATIC ISOCYANATE COMPOUND AND PRODUCTION PROCESS THEREOF SHOWA DENKO KK (JP) 2012-02-22 EP disclosed
US-8044235-B2 (Meth) acryloyl group-containing aromatic isocyanate compound and production process thereof SHOWA DENKO K.K. (JP) 2011-10-25 US disclosed
US-20090054543-A1 (Meth) Acryloyl Group-Containing Aromatic Isocyanate Compound and Production Process Thereof SHOWA DENKO K.K. (JP) 2009-02-26 US disclosed
EP-1866357-A1 (METH)ACRYLOYL GROUP-CONTAINING AROMATIC ISOCYANATE COMPOUND AND PRODUCTION PROCESS THEREOF Showa Denko K.K. (JP) 2007-12-19 EP disclosed
WO-2006103979-A1 (METH)ACRYLOYL GROUP-CONTAINING AROMATIC ISOCYANATE COMPOUND AND PRODUCTION PROCESS THEREOF SHOWA DENKO K.K. (JP) 2006-10-05 WO disclosed
EP-1493593-B1 Thermal transfer recording system having an amorphous dye phase POLAROID CORP (US) 2006-05-31 EP disclosed
CN-1210166-C Thermal transfer recording system having amorphous dye phase POLAROID CORP (US) 2005-07-13 CN disclosed
EP-1493593-A1 Thermal transfer recording system having an amorphous dye phase Polaroid Corporation (US) 2005-01-05 EP disclosed
EP-1263607-B1 THERMAL TRANSFER RECORDING SYSTEM HAVING AN AMORPHOUS DYE PHASE POLAROID CORP (US) 2004-12-01 EP disclosed
US-6537410-B2 Thermal transfer recording system POLAROID CORPORATION 2003-03-25 US disclosed
EP-1263607-A1 THERMAL TRANSFER RECORDING SYSTEM HAVING AN AMORPHOUS DYE PHASE POLAROID CORPORATION (US) 2002-12-11 EP disclosed
US-20010043239-A1 Thermal transfer recording system MOROOD INTERNATIONAL, SPC (SA) 2001-11-22 US disclosed
WO-2001056805-A1 THERMAL TRANSFER RECORDING SYSTEM HAVING AN AMORPHOUS DYE PHASE POLAROID CORPORATION (US) 2001-08-09 WO disclosed
US-4065435-A OXIDATION-REDUCTION PROPERTIES, ACRYLIC FUJI PHOTO FILM CO., LTD. (JA) 1977-12-27 US disclosed
US-3992449-A 2-(γ-Aminopropyl)hydroquinones and process for producing the same FUJI PHOTO FILM CO., LTD. (JA) 1976-11-16 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 (1 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-20090054543-A1 (Meth) Acryloyl Group-Containing Aromatic Isocyanate Compound and Production Process Thereof PRMT5, ACR, PRMT1 HTR1A 2283/4885HTR1D 1522/4885HTR1B 2095/4885

“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.