SCHEMBL17408808

SCHEMBL17408808

CC(C)(C)C1C(=O)NC(=O)N(c2ccccc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
MAOA P21397 1/20 0.40
ITGA4 P13612 1/20 0.40
ITGB7 P26010 1/20 0.40
MT-CO2 P00403 1/20 0.39
ALOX5 P09917 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ELANE P08246 1/20 0.39
GAA P10253 2/20 0.38
GRK5 P34947 1/20 0.38
TYRO3 Q06418 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
MGLL Q99685 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL9980773 0.73 ALDH1A1 (0.57) CACNA1BAPBA1MAPTALDH1A1HSD17B10
SCHEMBL1639996 0.72 ALDH1A1 (0.42) CACNA1BAPBA1MAPTALDH1A1HSD17B10
SCHEMBL17717930 0.72 ALDH1A1 (0.53) CACNA1BAPBA1MAPTALDH1A1HSD17B10
SCHEMBL11379242 0.72 CACNA1B (0.45) CACNA1BAPBA1MAPTALDH1A1HSD17B10
SCHEMBL18534249 0.71 MEN1 (0.50) CACNA1BAPBA1MAPTALDH1A1MAOA
SCHEMBL23334382 0.70 CACNA1B (0.46) CACNA1BAPBA1MAPTALDH1A1MAOA
SCHEMBL30558271 0.70 MGLL (0.41) CACNA1BAPBA1MAPTALDH1A1HSD17B10
SCHEMBL9696177 0.70 MAOA (0.40) CACNA1BAPBA1MAPTALDH1A1MAOA
SCHEMBL17358740 0.70 MAPT (0.49) CACNA1BAPBA1MAPTALDH1A1HSD17B10
SCHEMBL17717951 0.69 ALDH1A1 (0.60) MAPTALDH1A1HSD17B10KDM4CMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9433623-B2 Medicinal drug with activity against gram positive bacteria, mycobacteria and fungi LEVINA ELIZABETH (US) 2016-09-06 US disclosed
US-20160000786-A1 Medicinal Drug with Activity against Gram Positive Bacteria, Mycobacteria and Fungi LEVINA ELIZABETH (US) 2016-01-07 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-20160000786-A1 Medicinal Drug with Activity against Gram Positive Bacteria, Mycobacteria and Fungi TUBB3, GANAB, TUBB1 CACNA1B 3200/4885APBA1 3686/4885MAPT 374/4885

“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.