SCHEMBL1773407

SCHEMBL1773407

COC(=O)c1ccc(Cc2ccccc2CO)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.53
CYP4A11 Q02928 2/20 0.53
TSHR P16473 1/20 0.52
CYP4F2 P78329 1/20 0.51
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
RAB9A P51151 4/20 0.47
MAPT P10636 4/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 1/20 0.47
AR P10275 1/20 0.47
NPC1 O15118 1/20 0.47
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46

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
SCHEMBL9233909 0.86 LOXL2 (0.51) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL1773348 0.86 LOXL2 (0.51) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL8992964 0.85 MAPT (0.56) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL70372 0.84 TSHR (0.57) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL2579068 0.84 KEAP1 (0.56) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL9234838 0.83 RAB9A (0.52) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL305693 0.83 LOXL2 (0.56) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL481297 0.81 LOXL2 (0.61) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL6158387 0.81 TSHR (0.67) LOXL2CYP4A11TSHRCYP4F2CA1
SCHEMBL1774704 0.81 PKM (0.47) LOXL2CYP4A11TSHRCA1CA2

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 4 patents. 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
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
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
WO-2009097997-A1 SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF SANOFI-AVENTIS (FR) 2009-08-13 WO 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 LOXL2 2751/4885CYP4A11 261/4885TSHR 1338/4885

“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.