SCHEMBL6748837

SCHEMBL6748837

[CH2]c1ccc(OCc2c(F)cccc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.55
KDM4E B2RXH2 1/20 0.55
RAB9A P51151 1/20 0.55
HPGD P15428 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48
POLB P06746 1/20 0.48
AR P10275 1/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
TAAR1 Q96RJ0 1/20 0.46
MAPT P10636 1/20 0.45
TP53 P04637 1/20 0.45
ATM Q13315 1/20 0.44
ALKBH1 Q13686 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL6333131 0.88 SMN1; SMN2 (0.62) SMN1; SMN2KDM4ERAB9AALDH1A1KMT2A
SCHEMBL15380599 0.85 SMN1; SMN2 (0.56) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL12584868 0.84 SMN1; SMN2 (0.58) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL27850750 0.81 SMN1; SMN2 (0.53) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL13236911 0.81 SMN1; SMN2 (0.53) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL17514795 0.81 SMN1; SMN2 (0.52) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL4909005 0.80 SMN1; SMN2 (0.57) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL13216576 0.80 SMN1; SMN2 (0.52) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1
SCHEMBL4902482 0.80 MAOB (0.61) SMN1; SMN2KDM4ERAB9APOLBTAAR1
SCHEMBL29950824 0.80 SMN1; SMN2 (0.52) SMN1; SMN2KDM4ERAB9AHPGDALDH1A1

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-20040110665-A1 Desleucyl glycopeptide antibiotics and methods of making same KAHNE DANIEL (US) 2004-06-10 US disclosed
US-6699836-B2 Vancomycin analogs THE TRUSTEES OF PRINCETON UNIVERSITY 2004-03-02 US disclosed
EP-0667353-B1 Glycopeptide antibiotic derivatives LILLY CO ELI (US) 2003-10-29 EP disclosed
EP-1016670-B1 Glycopeptide antibiotic derivatives LILLY CO ELI (US) 2003-09-03 EP disclosed
US-6518243-B1 Desleucyl glycopeptide antibiotics and methods of making same TRUSTEES OF PRINCETON UNIVERSITY 2003-02-11 US disclosed
US-20020042365-A1 Vancomycin analogs TRUSTEES OF PRINCETON UNIVERSITY, THE 2002-04-11 US disclosed
EP-1016670-A1 Glycopeptide antibiotic derivatives ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
US-5977062-A ACTIVE AGAINST ANTIBIOTIC RESISTANT BACTERIA ELI LILLY AND COMPANY (US) 1999-11-02 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-20040110665-A1 Desleucyl glycopeptide antibiotics and methods of making same FUT6, FUT5, ST6GAL1 SMN1; SMN2 3997/4885KDM4E 3838/4885RAB9A 1400/4885
US-20020042365-A1 Vancomycin analogs VNN1, PTMS, ASNS SMN1; SMN2 4173/4885KDM4E 2977/4885RAB9A 3245/4885

“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.