SCHEMBL988243

SCHEMBL988243

N#Cc1cc(Br)c2[nH]ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.50
IMPDH1 P20839 1/20 0.50
XDH P47989 1/20 0.45
SLC22A12 Q96S37 1/20 0.45
TTR P02766 2/20 0.44
ALB P02768 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
RIPK1 Q13546 1/20 0.41
IKBKB O14920 1/20 0.40
CHUK O15111 1/20 0.40
CHEK1 O14757 4/20 0.37
CSNK2A1 P68400 1/20 0.34
HTT P42858 1/20 0.34
AHR P35869 2/20 0.33
CYP2A6 P11509 1/20 0.33
NR4A2 P43354 1/20 0.33
ESR1 P03372 1/20 0.33
PIM3 Q86V86 1/20 0.32
DYRK1A Q13627 1/20 0.32

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
SCHEMBL3707241 0.78 IMPDH2 (0.50) IMPDH2IMPDH1XDHSLC22A12TTR
SCHEMBL16636645 0.78 IMPDH2 (0.50) IMPDH2IMPDH1XDHSLC22A12TTR
SCHEMBL8530077 0.78 IMPDH2 (0.50) IMPDH2IMPDH1XDHSLC22A12RIPK1
SCHEMBL8995163 0.74 AHR (0.48) RIPK1IKBKBCHUKCHEK1CSNK2A1
SCHEMBL28597933 0.73 XDH (0.50) IMPDH2IMPDH1XDHSLC22A12TTR
SCHEMBL12585067 0.73 XDH (0.64) IMPDH2IMPDH1XDHSLC22A12IKBKB
SCHEMBL1137858 0.72 AHR (0.47) RIPK1IKBKBCHUKCSNK2A1AHR
SCHEMBL34460066 0.72 CSNK2A1 (0.38) RIPK1IKBKBCHUKCSNK2A1AHR
SCHEMBL21920740 0.71 IMPDH2 (0.44) IMPDH2IMPDH1XDHSLC22A12TTR
SCHEMBL1397681 0.71 CSNK2A1 (0.46) RIPK1IKBKBCHUKCHEK1CSNK2A1

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-3344604-B1 CARBOXY SUBSTITUTED (HETERO) AROMATIC RING DERIVATIVES AND PREPARATION METHOD AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2020-11-04 EP disclosed
CN-106478500-B Carboxylic acid substituted (hetero) aromatic ring derivatives, and preparation method and application thereof 广东东阳光药业有限公司 2020-02-11 CN disclosed
US-10266496-B2 Carboxy substituted (hetero) aromatic ring derivatives and preparation method and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-04-23 US disclosed
EP-3344604-A1 CARBOXY SUBSTITUTED (HETERO) AROMATIC RING DERIVATIVES AND PREPARATION METHOD AND USES THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2018-07-11 EP disclosed
WO-2017036404-A1 CARBOXY SUBSTITUTED (HETERO) AROMATIC RING DERIVATIVES AND PREPARATION METHOD AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-03-09 WO disclosed
EP-2565191-B1 4-(Indol-7-ylcarbonylaminomethyl)cyclohexanecarboxylic acid derivatives as EP4 receptor antagonists useful for the treatment of chronic renal failure or diabetic nephropathy ASTELLAS PHARMA INC (JP) 2014-10-08 EP disclosed
US-8598355-B2 Amide compound ASTELLAS PHARMA INC. (JP) 2013-12-03 US disclosed
EP-2565191-A1 4-(Indol-7-ylcarbonylaminomethyl)cyclohexanecarboxylic acid derivatives as EP4 receptor antagonists useful for the treatment of chronic renal failure or diabetic nephropathy Astellas Pharma Inc. (JP) 2013-03-06 EP disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
US-20110144153-A1 AMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-06-16 US disclosed
CN-102026961-A Amide compound ASTELLAS PHARMA INC 2011-04-20 CN disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP disclosed
EP-2277858-A1 AMIDE COMPOUND Astellas Pharma Inc. (JP) 2011-01-26 EP disclosed
WO-2009139373-A1 AMIDE COMPOUND アステラス製薬株式会社 (JP) 2009-11-19 WO 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 (2 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-20110144153-A1 AMIDE COMPOUND PTGER4, PTGER1, PTGER2 IMPDH2 3938/4885IMPDH1 4287/4885XDH 4659/4885
US-10266496-B2 Carboxy substituted (hetero) aromatic ring derivatives and preparation method and uses thereof XDH, ABCG2, SLC7A1 IMPDH2 1832/4885IMPDH1 1271/4885XDH 1/4885

“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.