SCHEMBL2946624

SCHEMBL2946624

COc1cccc2c1C(=O)c1c(cc(OC)c(C(=O)OC(C)(C)C)c1CBr)C2=O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC37A4 O43826 6/20 0.48
EGFR P00533 1/20 0.43
PIM1 P11309 1/20 0.43
ELANE P08246 8/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CTSG P08311 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
Anthraquinone SCHEMBL2948902 0.98 SLC37A4 (0.48) SLC37A4EGFRPIM1ELANEMEN1
Anthraquinone SCHEMBL2946623 0.90 SLC37A4 (0.45) SLC37A4MEN1KMT2A
SCHEMBL2955955 0.90 SLC37A4 (0.45) SLC37A4MEN1KMT2A
SCHEMBL2958068 0.84 ELANE (0.49) SLC37A4EGFRPIM1ELANEMEN1
SCHEMBL4463478 0.83 SLC37A4 (0.42) SLC37A4EGFRPIM1ELANEMEN1
SCHEMBL2955820 0.77 SLC37A4 (0.46) SLC37A4ELANEMEN1KMT2A
SCHEMBL2947006 0.76 SLC37A4 (0.48) SLC37A4ELANEMEN1KMT2A
SCHEMBL2957671 0.74 MAPT (0.44) SLC37A4MEN1KMT2A
SCHEMBL4463498 0.73 RAB9A (0.40) SLC37A4MEN1KMT2A
SCHEMBL9878218 0.72 EGFR (0.54) EGFRPIM1ELANEMEN1KMT2A

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-7763740-B2 Method for the production of mumbaistatin derivatives SANOFI-AVENTIS (FR) 2010-07-27 US disclosed
US-20090156836-A1 METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES SANOFI-AVENTIS (FR) 2009-06-18 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-20090156836-A1 METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES MMAB, MLYCD, HMBS SLC37A4 4052/4885EGFR 2996/4885PIM1 415/4885

“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.