SCHEMBL5402390

SCHEMBL5402390

Fc1c(Cl)cccc1Cc1cc(Cl)ncn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.41
KMO O15229 1/20 0.37
AKR1B1 P15121 1/20 0.35
EGFR P00533 2/20 0.34
RXRA P19793 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
PDE2A O00408 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
KCNH2 Q12809 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
CD38 P28907 1/20 0.31
PTPN1 P18031 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PTGER1 P34995 1/20 0.31
P2RX7 Q99572 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
PNMT P11086 1/20 0.31

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
SCHEMBL5410773 0.88 MPO (0.37) MPOAKR1B1RXRAGRIN1GRIN2B
SCHEMBL5408017 0.83 HTR2C (0.42) MPOPTGER1HTR2CHTR2BPNMT
SCHEMBL5412740 0.81 MEN1 (0.39) PTGER1
SCHEMBL5404815 0.78 TAAR1 (0.45)
SCHEMBL5404827 0.76 PKM (0.38) MPO
SCHEMBL5409941 0.76 MPO (0.34) MPOKMOEGFR
SCHEMBL5405081 0.74 TAAR1 (0.39) EGFR
SCHEMBL5399905 0.74 PPARG (0.44) P2RX7
SCHEMBL5410917 0.74 EGFR (0.41) EGFR
SCHEMBL5408353 0.73 PTGER1 (0.39) MPOPTGER1HTR2C

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-100415725-C Pyrimidine compound and application thereof SUMITOMO CHEMICAL CO (JP) 2008-09-03 CN disclosed
US-7291730-B2 Pyrimidine compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-06 US disclosed
US-7291730-B2 Pyrimidine compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-06 US disclosed
US-7291730-B2 Pyrimidine compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-06 US disclosed
US-20050107609-A1 Pyrimidine compounds and their use SUMITOMO CHEMICAL COMPANY 2005-05-19 US disclosed
US-6838463-B2 Pyrimidine compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-04 US disclosed
EP-1366026-B1 PYRIMIDINE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2004-12-01 EP disclosed
US-20040077669-A1 Pyrimidine compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-04-22 US disclosed
CN-1478082-A Pyrimidine compound and application thereof ס�ѻ�ѧ��ҵ��ʽ���� 2004-02-25 CN disclosed
EP-1366026-A2 PYRIMIDINE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2003-12-03 EP disclosed
WO-2002024663-A2 PYRIMIDINE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-28 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-20050107609-A1 Pyrimidine compounds and their use TYMP, TYMS, UMPS MPO 2864/4885KMO 1533/4885AKR1B1 875/4885
US-20040077669-A1 Pyrimidine compounds and their use TYMP, TYMS, DPYD MPO 3944/4885KMO 2525/4885AKR1B1 2117/4885

“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.