SCHEMBL16403173

SCHEMBL16403173

CC1(C)OB(c2ccnc(-c3ccc(F)cc3)c2)OC1(C)C

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPL P06858 8/20 0.59
LIPG Q9Y5X9 8/20 0.59
DGAT1 O75907 1/20 0.38
MAPKAPK2 P49137 2/20 0.36
TDO2 P48775 3/20 0.36
IDO1 P14902 2/20 0.36
TGFBR1 P36897 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
EGFR P00533 1/20 0.34
CXCR2 P25025 1/20 0.34

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
SCHEMBL19933806 0.85 MAP4K4 (0.43) LPLLIPGDGAT1MAPKAPK2TGFBR1
SCHEMBL2216147 0.85 LIPG (0.56) LPLLIPGDGAT1
SCHEMBL23347389 0.85 LPL (0.40) LPLLIPGDGAT1MAPKAPK2EGFR
SCHEMBL6224565 0.85 LPL (0.44) LPLLIPGMAPKAPK2IDO1
SCHEMBL21315497 0.82 MAPKAPK2 (0.40) LPLLIPGDGAT1MAPKAPK2TGFBR1
SCHEMBL20074691 0.81 TGFBR1 (0.42) LPLLIPGTGFBR1
SCHEMBL19764832 0.81 LPL (0.39) LPLLIPGDGAT1EGFR
SCHEMBL15298570 0.79 CYP2A6 (0.39) LPLLIPGDGAT1MAPKAPK2EGFR
SCHEMBL24625922 0.79 LIPG (0.51) LPLLIPGDGAT1MAPKAPK2TGFBR1
SCHEMBL29778746 0.79 LIPG (0.51) LPLLIPGDGAT1MAPKAPK2TGFBR1

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-9776997-B2 3-aryl-substituted imidazo[1,2-A]pyridines and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-10-03 US disclosed
EP-3004094-B1 3-ARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINES AND THE USE THEREOF Bayer Pharma AG (DE) 2017-03-01 EP disclosed
US-20160122341-A1 3-ARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-05-05 US disclosed
EP-3004094-A1 3-ARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINES AND THE USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2016-04-13 EP disclosed
WO-2014195333-A1 3-ARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINES AND THE USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-12-11 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-20160122341-A1 3-ARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINES AND THEIR USE PNPO, PAH, TNNI3 LPL 1697/4885LIPG 1282/4885DGAT1 4019/4885

“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.