SCHEMBL1773282

SCHEMBL1773282

COC(=O)c1ccc(C(=O)c2cccc(F)c2CBr)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 6/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LOXL2 Q9Y4K0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
TSHR P16473 1/20 0.41
MEN1 O00255 3/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
CA12 O43570 1/20 0.40
CA7 P43166 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
SCHEMBL5557509 0.85 LMNA (0.44) KMT2AALDH1A1MAPTSMN1; SMN2L3MBTL1
SCHEMBL8559193 0.82 AKR1C3 (0.47) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL1773164 0.80 KMT2A (0.56) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL1772614 0.77 TSHR (0.50) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL5250458 0.74 TSHR (0.56) KMT2AALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL29041518 0.73 LMNA (0.52) KMT2AALDH1A1MAPTKDM4ETSHR
SCHEMBL6687945 0.72 MAPT (0.58) KMT2AALDH1A1MAPTRAB9ANPC1
SCHEMBL1773501 0.72 NPC1 (0.46) KMT2AMAPTRAB9ANPC1HTT
SCHEMBL10676132 0.72 ALB (0.55) ALDH1A1RAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL20703521 0.72 KDM4E (0.44) KMT2AALDH1A1MAPTL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-05-12 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-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof GIPR, PGC, DDC KMT2A 2322/4885ALDH1A1 244/4885MAPT 4842/4885

“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.