SCHEMBL1691324

SCHEMBL1691324

CC(C)(C)N(C(=O)O)c1ccc2nc(-c3ccc(Br)cc3)c(CO)n2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 4/20 0.41
▸ GABRB2 P47870 4/20 0.41
▸ ALB P02768 2/20 0.41
▸ OPRK1 P41145 2/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ GABRA2 P47869 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ KCNK3 O14649 2/20 0.39
▸ KCNK9 Q9NPC2 2/20 0.39

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
Trifluoroacetic Acid SCHEMBL1691777 0.78 SLC2A1 (0.44) GABRA1GABRB2ALBOPRK1KCNH2
SCHEMBL1691573 0.77 SLC2A1 (0.52) GABRA1GABRB2ALBOPRK1KCNH2
SCHEMBL14632080 0.77 AKT1 (0.43) GABRA1GABRB2ALBOPRK1KCNH2
SCHEMBL14632132 0.77 MCHR1 (0.42) GABRA1GABRB2ALBOPRK1KCNH2
SCHEMBL1691294 0.75 SLC2A1 (0.43) GABRA1GABRB2ALBOPRK1KCNH2
SCHEMBL1691912 0.74 APP (0.63) KDM4EHPGDNPC1GAARAB9A
Trifluoroacetic Acid SCHEMBL1691729 0.74 GABRA2 (0.50) GABRB2ALBOPRK1KCNH2GABRA2
SCHEMBL1691720 0.73 AKT1 (0.46) GABRA1GABRB2ALBOPRK1KCNH2
SCHEMBL1692145 0.73 ALDH1A1 (0.58) GABRB2ALBOPRK1KCNH2KDM4E
SCHEMBL1691844 0.72 SLC2A1 (0.51) GABRA1GABRB2KDM4EHPGDKCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150239905-A1 IMIDAZOPYRIDINE COMPOUNDS BIOVITRUM AB (PUBL) (SE) 2015-08-27 — — US disclosed
US-20140206662-A1 Imidazopyridine Compounds PROXIMAGEN LTD. (GB) 2014-07-24 — — US disclosed
US-20120010188-A1 Imidazopyridine Compounds PROMIMAGEN LTD. (GB) 2012-01-12 — — 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 (3 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-20120010188-A1 Imidazopyridine Compounds SSB, MIF, IDO1 GABRA1 1605/4885GABRB2 2456/4885ALB 1143/4885
US-20150239905-A1 IMIDAZOPYRIDINE COMPOUNDS SSB, MIF, IDO1 GABRA1 1605/4885GABRB2 2456/4885ALB 1143/4885
US-20140206662-A1 Imidazopyridine Compounds SSB, NFKBIA, TPMT GABRA1 1324/4885GABRB2 1903/4885ALB 41/4885

“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.

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