SCHEMBL4824847

SCHEMBL4824847

[NH]C(=O)C=NOCc1csc(N)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.47
GABRB2 P47870 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 2/20 0.43
RAB9A P51151 5/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 4/20 0.41
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NOS1 P29475 1/20 0.36
AOC3 Q16853 1/20 0.35

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
SCHEMBL3999942 0.88 GABRA5 (0.51) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL2789164 0.88 GABRA5 (0.51) GABRA5GABRB2HSD17B10MAPTRAB9A
Hydrochloric Acid SCHEMBL8913011 0.87 GABRA5 (0.50) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL8896803 0.82 NPC1 (0.47) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL8896790 0.82 NPC1 (0.47) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL10404051 0.81 HSD17B10 (0.33) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL8723035 0.78 MAPT (0.44) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL9089346 0.78 MAPT (0.44) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL8768619 0.78 GABRA5 (0.38) GABRA5GABRB2HSD17B10MAPTRAB9A
SCHEMBL8135644 0.75 GABRA5 (0.43) GABRA5GABRB2HSD17B10MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7335767-B2 Method for preparation of ceftiofur and salts thereof LUPIN LIMITED (IN) 2008-02-26 US disclosed
US-20040132996-A1 Method for preparation of ceftiofur and salts thereof LUPIN LIMITED 2004-07-08 US disclosed
US-5656623-A BACTERICIDES; ANTIBIOTICS THE PROCTER & GAMBLE COMPANY (US) 1997-08-12 US disclosed
EP-0366189-A2 Novel antimicrobial lactam-quinolones Norwich Eaton Pharmaceuticals, Inc. (US) 1990-05-02 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 (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-20040132996-A1 Method for preparation of ceftiofur and salts thereof MRPL21, ME1, CA6 GABRA5 2704/4885GABRB2 2405/4885HSD17B10 503/4885

“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.