SCHEMBL2568233

SCHEMBL2568233

CC(C)(C)c1nc(I)c(I)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
BRAF P15056 1/20 0.32

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
SCHEMBL14953292 0.66 NPSR1 (0.36) L3MBTL1ALDH1A1
SCHEMBL585021 0.65
SCHEMBL306801 0.64
SCHEMBL846648 0.62 KDM4E (0.56) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL3695099 0.62 L3MBTL1 (0.40) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL21719353 0.62 L3MBTL1 (0.31) L3MBTL1
SCHEMBL12118168 0.60 L3MBTL1 (0.39) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL13208621 0.60 L3MBTL1 (0.43) L3MBTL1BRAF
SCHEMBL552591 0.60 L3MBTL1 (0.39) L3MBTL1
SCHEMBL21719843 0.60 NPC1 (0.31) L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289502-A1 IMIDAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-11-15 US disclosed
US-8273738-B2 Imidazole derivatives KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-09-25 US disclosed
EP-2090570-B1 IMIDAZOLE DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2011-11-09 EP disclosed
US-20100152178-A1 IMIDAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-06-17 US disclosed
EP-2090570-A1 IMIDAZOLE DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2009-08-19 EP 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 (2 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-20120289502-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 L3MBTL1 4253/4885ALDH1A1 2997/4885SMN1; SMN2 4654/4885
US-20100152178-A1 IMIDAZOLE DERIVATIVES CNR1, CNR2, ARRB1 L3MBTL1 4253/4885ALDH1A1 2997/4885SMN1; SMN2 4654/4885

“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.