SCHEMBL633282

SCHEMBL633282

CCC(=O)c1cccc(F)c1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.61
CES1 P23141 4/20 0.61
BCHE P06276 1/20 0.61
HPGD P15428 1/20 0.47
RXFP1 Q9HBX9 1/20 0.43
ALB P02768 1/20 0.42
PDK2 Q15119 1/20 0.42
PTPN1 P18031 1/20 0.42
ERCC5 P28715 1/20 0.42
FEN1 P39748 1/20 0.42
GAA P10253 1/20 0.41
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 1/20 0.41
KAT6A Q92794 1/20 0.41
HSP90AB1 P08238 1/20 0.40
RIPK1 Q13546 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL31599609 1.00 CES2 (0.61) CES2CES1BCHEHPGDRXFP1
SCHEMBL11836782 0.85 CES2 (0.57) CES2CES1BCHEHPGDALB
SCHEMBL9118756 0.85 CES2 (0.47) CES2CES1BCHEHPGDRXFP1
SCHEMBL1155949 0.83 PTPN1 (0.58) CES2CES1HPGDRXFP1PTPN1
SCHEMBL30036725 0.83 PTPN1 (0.58) CES2CES1HPGDRXFP1PTPN1
SCHEMBL24803066 0.82 KAT6A (0.44) CES2CES1BCHEHPGDPDK2
SCHEMBL4598039 0.82 ALB (0.60) CES2CES1BCHERXFP1ALB
SCHEMBL28089899 0.82 HSP90AB1 (0.47) CES2CES1BCHEHPGDPDK2
SCHEMBL2373430 0.82 CES2 (0.59) CES2CES1BCHEHPGDRXFP1
SCHEMBL13722818 0.82 CES2 (0.63) CES2CES1BCHEHPGDALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107892693-A A kind of preparation method of ticagrelor 安徽诺全药业有限公司 2018-04-10 CN claimed
CN-107686447-A A kind of preparation method of ticagrelor intermediate 许昌恒生制药有限公司 2018-02-13 CN claimed
CN-106906249-A Ticagrelor intermediate and preparation method of mandelate thereof 辽宁天华生物药业有限公司 2017-06-30 CN claimed
CN-104744266-B The preparation method of ticagrelor intermediate 上虞京新药业有限公司 2017-06-27 CN claimed
CN-105671099-A Method for preparing optical pure difluorophenyl ethylene oxide 中国科学院成都生物研究所 2016-06-15 CN claimed
CN-102807563-A Method for preparing voriconazole and intermediate thereof NANJING HUAWE MEDICAL SCIENCE & TECHNOLOGY DEV CO LTD 2012-12-05 CN claimed
US-12404253-B2 2,4,6-trisubstituted 1,3,5-triazines as modulators of CX3CR1 ASTRAZENECA AB (SE) 2025-09-02 US disclosed
EP-4605388-A1 <SUP2/>? <SUB2/>?3?2,4,6-TRISUBSTITUTED 1,3,5-TRIAZINES AS MODULATORS OF CXCR1 Astrazeneca AB (SE) 2025-08-27 EP disclosed
US-20240383866-A1 2,4,6-TRISUBSTITUTED 1,3,5-TRIAZINES AS MODULATORS OF CX3CR1 ASTRAZENECA AB (SE) 2024-11-21 US disclosed
US-20240199558-A1 2,4,6-TRISUBSTITUTED 1,3,5-TRIAZINES AS MODULATORS OF CX3CR1 ASTRAZENECA AB (SE) 2024-06-20 US disclosed
WO-2024083933-A1 2,4,6-TRISUBSTITUTED 1,3,5-TRIAZINES AS MODULATORS OF CX 3CR1 ASTRAZENECA AB (SE) 2024-04-25 WO disclosed
WO-2021047166-A1 METHOD FOR SYNTHESIZING TRANYLCYPROMINE INTERMEDIATE 凯特立斯(深圳)科技有限公司 2021-03-18 WO disclosed
CN-110627628-A Beta-iodo-difluoropropanone derivative and preparation method thereof 上海应用技术大学 2019-12-31 CN disclosed
US-20090192138-A1 COMPOUNDS BAESCHLIN DANIEL KASPAR 2009-07-30 US disclosed
WO-2007071738-A1 CONDENSED HETEROCYCLIC COMPOUNDS USEFUL AS DPP-IV INHIBITORS NOVARTIS AG (CH) 2007-06-28 WO disclosed
US-20070122741-A1 Resist protective coating material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-05-31 US disclosed
EP-1401819-A1 5-HT RECEPTOR LIGANDS AND USES THEREOF Pfizer Products Inc. (US) 2004-03-31 EP disclosed
WO-2003000663-A1 5-HT RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2003-01-03 WO disclosed
US-20020004569-A1 Polymer, chemically amplified resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-01-10 US disclosed
US-5104870-A Psychological disorders BURROUGHS WELLCOME CO. (US) 1992-04-14 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 (4 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-20240199558-A1 2,4,6-TRISUBSTITUTED 1,3,5-TRIAZINES AS MODULATORS OF CX3CR1 CX3CR1, CCR2, CCR5 CES2 3829/4885CES1 4432/4885BCHE 4871/4885
US-20240383866-A1 2,4,6-TRISUBSTITUTED 1,3,5-TRIAZINES AS MODULATORS OF CX3CR1 CX3CR1, CCR2, CCR5 CES2 3829/4885CES1 4432/4885BCHE 4871/4885
US-12404253-B2 2,4,6-trisubstituted 1,3,5-triazines as modulators of CX3CR1 CX3CR1, CCR2, CCR5 CES2 3829/4885CES1 4432/4885BCHE 4871/4885
US-20090192138-A1 COMPOUNDS DPP4, DPP3, DPP8 CES2 141/4885CES1 155/4885BCHE 109/4885

“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.