SCHEMBL5063471

SCHEMBL5063471

O=C(Cl)c1ccc(-c2ccccc2)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.55
ACMSD Q8TDX5 3/20 0.52
HNF4A P41235 2/20 0.52
AKR1C2 P52895 1/20 0.51
AKR1C1 Q04828 1/20 0.51
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 1/20 0.50
ERCC5 P28715 2/20 0.49
FEN1 P39748 2/20 0.49
MKNK1 Q9BUB5 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
SMO Q99835 1/20 0.47
DHFR P00374 1/20 0.47
MCL1 Q07820 1/20 0.47
FLT1 P17948 2/20 0.47
FLT4 P35916 2/20 0.47
KDR P35968 2/20 0.47
DCLRE1A Q6PJP8 1/20 0.46
DCLRE1B Q9H816 1/20 0.46
ACLY P53396 2/20 0.46

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
SCHEMBL120353 0.86 ACMSD (0.63) ESR2ACMSDHNF4AAKR1C2AKR1C1
SCHEMBL11037121 0.84 ACMSD (0.55) ESR2ACMSDHNF4AAKR1C2AKR1C1
SCHEMBL11150735 0.83 ESR2 (0.53) ESR2ACMSDHNF4AAKR1C2AKR1C1
SCHEMBL27803956 0.81 CDC25B (0.53) ESR2ACMSDHNF4AAKR1C2AKR1C1
SCHEMBL10623435 0.81 ESR2 (0.52) ESR2ACMSDHNF4AAKR1C2AKR1C1
SCHEMBL11476855 0.80 ERCC5 (0.42) AKR1C2AKR1C1HDAC8HDAC6ERCC5
SCHEMBL4864533 0.79 ALDH1A1 (0.57) ACMSDHNF4AAKR1C2AKR1C1DHFR
SCHEMBL10911662 0.79 RXRB (0.50) ACMSDHNF4AMKNK1MKNK2DHFR
SCHEMBL6502082 0.79 PDK2 (0.57) ESR2HDAC8HDAC6ERCC5FEN1
SCHEMBL28184683 0.78 AVPR2 (0.50) ERCC5FEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103635837-A Polarizing photochromic articles TRANSITIONS OPTICAL INC 2014-03-12 CN disclosed
CN-101727004-B Photoacid generator containing aromatic ring KOREA KUMHO PETROCHEM CO LTD 2013-05-22 CN disclosed
CN-102934011-A Liquid crystal alignment agent containing end-modified polyamic acid ester, and liquid crystal alignment film NISSAN CHEMICAL IND LTD 2013-02-13 CN disclosed
CN-102893206-A Liquid crystal alignment agent containing end-modified polyamic acid ester, and liquid crystal alignment film NISSAN CHEMICAL IND LTD 2013-01-23 CN disclosed
CN-101727004-A Photoacid generator containing aromatic ring KOREA KUMHO PETROCHEM CO LTD 2010-06-09 CN disclosed
CN-100416302-C Thermoplastic norbornene resin based optical film JSR CORP (JP) 2008-09-03 CN disclosed
CN-100416314-C Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL INC (US) 2008-09-03 CN disclosed
US-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US disclosed
EP-1867639-A1 UREA DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2007-12-19 EP disclosed
CN-1842730-A Polarizing, photochromic devices and methods of making the same TRANSITIONS OPTICAL INC (US) 2006-10-04 CN disclosed
CN-1608214-A Thermoplastic norbornene resin based optical film JSR CORP (JP) 2005-04-20 CN 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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these AVPR2, UTS2R, GPR119 ESR2 362/4885ACMSD 1754/4885HNF4A 878/4885

“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.