SCHEMBL5121689

SCHEMBL5121689

CCOC(=O)/C(NC=O)=C(/Br)c1ccccc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2R P25116 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 1/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 3/20 0.40
GAA P10253 2/20 0.40
DHODH Q02127 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 3/20 0.40
S1PR4 O95977 1/20 0.40
S1PR1 P21453 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL5121691 1.00 F2R (0.43) F2RMEN1KMT2ATSHRHPGD
SCHEMBL5116572 0.86 LMNA (0.45) MEN1KMT2ATSHRHPGDMAPT
SCHEMBL5116566 0.86 LMNA (0.45) MEN1KMT2ATSHRHPGDMAPT
SCHEMBL5125412 0.86 F2R (0.43) F2RMEN1KMT2ATSHRHPGD
SCHEMBL5125411 0.86 F2R (0.43) F2RMEN1KMT2ATSHRHPGD
SCHEMBL3492881 0.82 ALDH1A1 (0.48) MEN1KMT2ATSHRMAPTGAA
SCHEMBL3492883 0.82 ALDH1A1 (0.48) MEN1KMT2ATSHRMAPTGAA
SCHEMBL6218131 0.77 TSHR (0.47) F2RMEN1KMT2ATSHRHPGD
SCHEMBL6218130 0.77 TSHR (0.47) F2RMEN1KMT2ATSHRHPGD
SCHEMBL5126431 0.74 LMNA (0.46) MEN1KMT2ATSHRHPGDMAPT

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-20080161573-A1 PROCESS FOR THE PREPARATION OF IMIQUIMOD AND INTERMEDIATES THEREOF DIPHARMA S.P.A. (IT) 2008-07-03 US disclosed
US-7301027-B2 Process for the preparation of Imiquimod and intermediates thereof DIPHARMA S.P.A. (IT) 2007-11-27 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-20080161573-A1 PROCESS FOR THE PREPARATION OF IMIQUIMOD AND INTERMEDIATES THEREOF MYD88, TLR7, MAVS F2R 2463/4885MEN1 3676/4885KMT2A 1184/4885

“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.