SCHEMBL1773501

SCHEMBL1773501

COC(=O)c1ccc(C(=O)c2cc(F)ccc2CBr)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
MAPT P10636 4/20 0.46
MAPK1 P28482 2/20 0.46
HTT P42858 1/20 0.46
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAP2K4 P45985 1/20 0.42
CCR6 P51684 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
POLB P06746 2/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
DPP4 P27487 2/20 0.40
PARP1 P09874 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL29604367 0.85 SLC6A4 (0.44) NPC1RAB9AMAPTHTTSMN1; SMN2
SCHEMBL1435113 0.85 SLC6A4 (0.44) NPC1RAB9AMAPTHTTSMN1; SMN2
SCHEMBL1773628 0.81 MDM2 (0.46) MAPK1
SCHEMBL1772091 0.81 GAA (0.48) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL1773115 0.80 KMT2A (0.50) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL1772614 0.80 TSHR (0.50) NPC1RAB9AKMT2AMAPTATM
SCHEMBL1772786 0.79 MAOB (0.45)
SCHEMBL1773490 0.79 CDC25B (0.47) NPC1RAB9AKMT2AMEN1ATM
SCHEMBL1773321 0.79 GSK3B (0.47)
SCHEMBL8068763 0.78 PTPN1 (0.34) HTT

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 NPC1 2492/4885RAB9A 1148/4885KMT2A 2322/4885

“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.