SCHEMBL1670400

SCHEMBL1670400

CCN(c1ccccc1)c1cccc(O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.63
CYP3A4 P08684 2/20 0.63
TSHR P16473 2/20 0.53
HTR7 P34969 4/20 0.47
NR3C2 P08235 1/20 0.44
OPRK1 P41145 4/20 0.43
ADRA1D P25100 2/20 0.43
ADRA1A P35348 2/20 0.43
ADRA1B P35368 2/20 0.43
LMNA P02545 2/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CYP2D6 P10635 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
SLC6A4 P31645 1/20 0.43
CYP2C19 P33261 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
SCHEMBL19495082 0.87 CYP3A4 (0.58) ALDH1A1CYP3A4TSHRHTR7NR3C2
SCHEMBL19494975 0.86 ALDH1A1 (0.56) ALDH1A1CYP3A4TSHRHTR7NR3C2
SCHEMBL19654986 0.83 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRHTR7OPRK1
SCHEMBL19654985 0.83 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHROPRK1ADRA1D
SCHEMBL1669547 0.82 HTR7 (0.56) ALDH1A1CYP3A4TSHRHTR7OPRK1
SCHEMBL6881367 0.82 ESR1 (0.51) ALDH1A1CYP3A4TSHRNR3C2MAPT
SCHEMBL6567347 0.81 NR3C2 (0.57) ALDH1A1TSHRNR3C2ADRA1AHTR1A
SCHEMBL409370 0.81 NR3C2 (0.57) ALDH1A1TSHRNR3C2ADRA1AHTR1A
SCHEMBL19494974 0.81 ALDH1A1 (0.50) ALDH1A1CYP3A4TSHRHTR7OPRK1
SCHEMBL19661598 0.81 ALDH1A1 (0.50) ALDH1A1CYP3A4TSHRHTR7OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696898-B2 Reverse photochromic compound FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2020-06-30 US disclosed
US-10377713-B2 Quencher FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-08-13 US disclosed
US-20170342031-A1 QUENCHER WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-11-30 US disclosed
US-20170342031-A1 QUENCHER WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-11-30 US disclosed
WO-2014208767-A1 COLORED CURABLE RESIN COMPOSITION 住友化学株式会社 (JP) 2014-12-31 WO disclosed
EP-2485900-B1 MULTICOLOUR THERMAL IMAGING MATERIAL ZINK IMAGING INC (US) 2014-05-21 EP disclosed
US-8372782-B2 Imaging system ZINK IMAGING, INC. (US) 2013-02-12 US disclosed
EP-2485900-A1 MULTICOLOUR THERMAL IMAGING MATERIAL Zink Imaging, Inc. (US) 2012-08-15 EP disclosed
EP-1597084-B1 IMAGING SYSTEM ZINK IMAGING LLC (US) 2012-04-11 EP disclosed
WO-2011044049-A1 MULTICOLOUR THERMAL IMAGING MATERIAL ZINK IMAGING, INC. (US) 2011-04-14 WO disclosed
US-7176161-B2 Containing crystalline compounds which produce color when thermally converted to liquid or amorphous form time-independent ZINK IMAGING, LLC (US) 2007-02-13 US disclosed
EP-1597084-A2 IMAGING SYSTEM Polaroid Corporation (US) 2005-11-23 EP disclosed
WO-2004078479-A2 IMAGING SYSTEM POLAROID CORPORATION (US) 2004-09-16 WO disclosed
US-20040176248-A1 Imaging system ZINK HOLDINGS LLC 2004-09-09 US disclosed
EP-0613928-B1 1:2 chromium complex dyes BAYER AG (DE) 1999-10-13 EP disclosed
US-5484900-A METALLIZED DYES FOR LEATHER, WOOL, SILK OR SYNTHETIC SUBSTRATES BAYER AKTIENGESELLSCHAFT (DE) 1996-01-16 US disclosed
EP-0613928-A1 1:2 chromium complex dyes BAYER AG (DE) 1994-09-07 EP disclosed
US-RE30199-E Oxidation hair dyes based upon tetraaminopyrimidine developers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1980-01-29 US disclosed
EP-0005451-A2 Process for the manufacture of cationic oxazinic compounds, the oxazinic compounds and their application to the dyeing and printing of textile materials CIBA-GEIGY AG (CH) 1979-11-28 EP disclosed
US-4003699-A Oxidation hair dyes based upon tetraaminopyrimidine developers HENKEL & CIE G.M.B.H. (DT) 1977-01-18 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-10696898-B2 Reverse photochromic compound CRY1, CRY2, C3AR1 ALDH1A1 840/4885CYP3A4 683/4885TSHR 1792/4885
US-10377713-B2 Quencher AHR, GFER, AKR1A1 ALDH1A1 365/4885CYP3A4 438/4885TSHR 1813/4885
US-20170342031-A1 QUENCHER AHR, GFER, AKR1A1 ALDH1A1 365/4885CYP3A4 438/4885TSHR 1813/4885

“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.