SCHEMBL14079745

SCHEMBL14079745

Cc1nc2ccc(NC(=O)OC(C)C)cc2s1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.67
MAPT P10636 6/20 0.65
RAB9A P51151 13/20 0.63
NPC1 O15118 10/20 0.63
SMN1; SMN2 Q16637 8/20 0.63
HTT P42858 1/20 0.63
ALDH1A1 P00352 4/20 0.59
KDM4E B2RXH2 2/20 0.59
KMT2A Q03164 2/20 0.59
POLB P06746 2/20 0.59
GAA P10253 2/20 0.57
CASP3 P42574 1/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
MEN1 O00255 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL12312851 0.84 KDM4E (0.48) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL15304477 0.84 KDM4E (0.48) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL14079746 0.83 LDHA (0.68) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL4664159 0.82 LDHA (0.80) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL14079744 0.82 LDHA (0.67) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL3923955 0.80 LDHA (1.00) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL897155 0.80 MAPT (0.69) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL15195866 0.79 LDHA (0.76) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL30387733 0.77 NPC1 (1.00) LDHAMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL14907231 0.77 MAPT (0.74) LDHAMAPTRAB9ANPC1SMN1; SMN2

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-20080193700-A1 Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2008-08-14 US disclosed
US-20080193700-A1 Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2008-08-14 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-20080193700-A1 Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity TMCO1, KCNN3, CACNA1F LDHA 3605/4885MAPT 580/4885RAB9A 1255/4885

“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.