SCHEMBL6918342

SCHEMBL6918342

CCCCCOc1nccc(Cl)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.45
MCHR1 Q99705 2/20 0.39
CYP19A1 P11511 1/20 0.37
NR5A1 Q13285 1/20 0.37
LTA4H P09960 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
TLR8 Q9NR97 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
RXRA P19793 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SOAT1 P35610 1/20 0.34

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
SCHEMBL22576627 0.86 SMN1; SMN2 (0.41) MAPK8SMN1; SMN2HSD17B10RXRAGRIN1
SCHEMBL7029492 0.81 POLB (0.42) MAPK8SMN1; SMN2RXRAGRIN1GRIN2B
SCHEMBL3513367 0.80 RXRA (0.33) MAPK8RXRAGRIN1GRIN2B
SCHEMBL7783352 0.80 MAPK8 (0.46) MAPK8MCHR1CYP19A1NR5A1LTA4H
SCHEMBL6223037 0.80 TSHR (0.38) SMN1; SMN2HSD17B10RXRAGRIN1GRIN2B
SCHEMBL4582943 0.78 RECQL (0.37) MAPK8RXRAGRIN1GRIN2B
SCHEMBL84523 0.76 KCNH2 (0.40) CYP3A4TLR8LMNACYP1A2CYP2C9
SCHEMBL4860109 0.75 KCNH2 (0.43) CYP3A4HSD17B10LMNA
SCHEMBL13347716 0.75 PTGS2 (0.46) MAPK8NR5A1TLR8SMN1; SMN2RXRA
SCHEMBL4541652 0.74 LTA4H (0.44) MAPK8MCHR1CYP19A1NR5A1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6734304-B2 REACTING THE CORRESPONDING 4.6-DIHALOPYRIMIDINE COMPOUND WITH BASE; ONE POT PROCESS BAYER AKTIENGESELLSCHAFT (DE) 2004-05-11 US disclosed
US-20030092723-A1 Method for producing asymmetrical 4,6-bis(aryloxy)pyrimidine derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-05-15 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 (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-20030092723-A1 Method for producing asymmetrical 4,6-bis(aryloxy)pyrimidine derivatives DPYD, TYMS, TYMP MAPK8 3389/4885MCHR1 4591/4885CYP19A1 1105/4885

“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.