SCHEMBL507788

SCHEMBL507788

CC(C)[Si](OC[C@H](COCc1ccccc1)Oc1ccc(-c2ccc(OC(F)(F)F)cc2)cc1)(C(C)C)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 4/20 0.48
AR P10275 2/20 0.40
SERPINE1 P05121 1/20 0.37
SCN9A Q15858 1/20 0.36
DAGLA Q9Y4D2 3/20 0.35
PLA2G10 O15496 1/20 0.35
PLA2G2A P14555 1/20 0.35
SLC7A5 Q01650 2/20 0.34
ATP1A1 P05023 1/20 0.34
ATP1B1 P05026 1/20 0.34
ATP1A3 P13637 1/20 0.34
ATP1B2 P14415 1/20 0.34
ATP1A2 P50993 1/20 0.34
ATP1B3 P54709 1/20 0.34
FXYD2 P54710 1/20 0.34
ATP1A4 Q13733 1/20 0.34
MCL1 Q07820 1/20 0.33
SCN5A Q14524 1/20 0.33
PTGER4 P35408 1/20 0.33
DAGLB Q8NCG7 1/20 0.33

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
SCHEMBL508904 0.80 TRPV3 (0.39) SCN10ASCN9ASCN5A
SCHEMBL17108362 0.74 PPARG (0.52)
SCHEMBL17091450 0.73 LMNA (0.50)
SCHEMBL21277580 0.73 GSTP1 (0.50) MCL1
SCHEMBL5105144 0.68 MRGPRX4 (0.58) SCN10ASERPINE1MCL1PTGER4
SCHEMBL509011 0.68 CA1 (0.57)
SCHEMBL10447860 0.65 CA1 (0.50) SCN10A
SCHEMBL1315107 0.65 TSHR (0.46)
SCHEMBL21432857 0.65 L3MBTL1 (0.45) PLA2G10PLA2G2A
SCHEMBL306823 0.64 KIF11 (0.50) SERPINE1SCN5AGRIN2B

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-9198913-B2 Nitroimidazooxazines and their uses in anti-tubercular therapy GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2015-12-01 US disclosed
EP-2459571-B1 NITROIMIDAZOOXAZINES AND THEIR USES IN ANTI-TUBERCULAR THERAPY GLOBAL ALLIANCE FOR TB DRUG DEV (US) 2015-03-11 EP disclosed
US-20120028973-A1 NITROIMIDAZOOXAZINES AND THEIR USES IN ANTI-TUBERCULAR THERAPY GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT (US) 2012-02-02 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-20120028973-A1 NITROIMIDAZOOXAZINES AND THEIR USES IN ANTI-TUBERCULAR THERAPY NOX5, MT-ND5, NQO1 SCN10A 4460/4885AR 4094/4885SERPINE1 4278/4885

“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.