SCHEMBL6402998

SCHEMBL6402998

O=C(O)c1cc(=O)c(OCCCCCOc2cccc(Cl)c2)co1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.47
KDM4E B2RXH2 3/20 0.47
PPARG P37231 5/20 0.46
PPARD Q03181 5/20 0.46
FFAR1 O14842 4/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46
NR4A2 P43354 1/20 0.45
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42

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
SCHEMBL6400666 0.87 SMN1; SMN2 (0.44) HRH3NR4A2
SCHEMBL6395332 0.86 MRGPRX4 (0.46) KDM4E
SCHEMBL6397512 0.84 MRGPRX4 (0.47) KDM4E
SCHEMBL6397846 0.82 RAB9A (0.53) HRH3KDM4E
SCHEMBL10328598 0.81 LDHA (0.54) FFAR1RXRARXRBRXRGNR4A2
SCHEMBL10494168 0.77 MEN1 (0.50) TP53TSHR
SCHEMBL10328548 0.77 MEN1 (0.50) TP53TSHR
SCHEMBL6402963 0.77 MRGPRX4 (0.48) KDM4ETSHR
SCHEMBL10328605 0.76 MEN1 (0.48) TP53TSHR
SCHEMBL10328642 0.74 PTGER4 (0.37) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 US claimed
US-6552073-B1 As anti-proliferative agent; for therapy of cancer EXONHIT THERAPEUTICS SA (FR) 2003-04-22 US claimed
US-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 US disclosed
US-6552073-B1 As anti-proliferative agent; for therapy of cancer EXONHIT THERAPEUTICS SA (FR) 2003-04-22 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-20050054629-A1 Compounds and methods of treating cell proliferative diseases MKI67, CCNC, PCNA HRH3 2816/4885KDM4E 1761/4885PPARG 218/4885

“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.