SCHEMBL6400666

SCHEMBL6400666

O=C(O)c1cc(=O)c(OCCCCCOc2ccc(Cl)cc2)co1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
HRH3 Q9Y5N1 8/20 0.43
PTGER4 P35408 2/20 0.42
DAO P14920 1/20 0.42
NR4A2 P43354 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.40
ABCB11 O95342 1/20 0.40

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
SCHEMBL6395332 0.89 MRGPRX4 (0.46) SMN1; SMN2MRGPRX4PTGER4DAOMEN1
SCHEMBL6397512 0.88 MRGPRX4 (0.47) SMN1; SMN2MRGPRX4PTGER4DAOMEN1
SCHEMBL6402998 0.87 HRH3 (0.47) HRH3NR4A2
SCHEMBL6395112 0.84 ALDH1A1 (0.51) SMN1; SMN2PTGER4MEN1KMT2A
SCHEMBL10328542 0.82 MRGPRX4 (0.50) SMN1; SMN2HSD17B10MRGPRX4PTGER4NR4A2
SCHEMBL6397218 0.81 DAO (0.55) DAOMEN1KMT2A
SCHEMBL10328548 0.80 MEN1 (0.50) MEN1KMT2A
SCHEMBL10494168 0.80 MEN1 (0.50) MEN1KMT2A
SCHEMBL6900481 0.80 MEN1 (0.42) PTGER4MEN1KMT2A
SCHEMBL10328605 0.79 MEN1 (0.48) MEN1KMT2A

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 8 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-6878722-B2 Substituted cycloalkyl P1′ hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-04-12 US disclosed
US-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 US disclosed
EP-1480966-A1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES Exonhit Therapeutics S.A. (FR) 2004-12-01 EP disclosed
US-20040077551-A1 Substituted cycloalkyl P1' hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-04-22 US disclosed
WO-2003074508-A1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES EXONHIT THERAPEUTICS SA (FR) 2003-09-12 WO 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 (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-20050054629-A1 Compounds and methods of treating cell proliferative diseases MKI67, CCNC, PCNA SMN1; SMN2 1723/4885HSD17B10 1433/4885MRGPRX4 3301/4885
US-20040077551-A1 Substituted cycloalkyl P1' hepatitis C virus inhibitors HAVCR2, ANPEP, ENPEP SMN1; SMN2 4827/4885HSD17B10 2224/4885MRGPRX4 938/4885

“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.