SCHEMBL6403763

SCHEMBL6403763

NC(=O)N1C(=O)NC(c2ccccc2F)C1=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.50
TSHR P16473 2/20 0.40
KCNN4 O15554 4/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.38
CYP2C19 P33261 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
KDM1A O60341 2/20 0.38
KDM1B Q8NB78 1/20 0.38
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PDE6D O43924 1/20 0.36

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
SCHEMBL6403766 0.78 GAA (0.44) GAATSHRALDH1A1TNKS2KDM1A
SCHEMBL6399674 0.78 LMNA (0.50) TSHRALDH1A1MEN1KMT2A
SCHEMBL6401309 0.78 LMNA (0.50) TSHRALDH1A1MEN1KMT2A
SCHEMBL6398623 0.70 ESR1 (0.40) ALDH1A1HSD17B10MEN1KMT2AKDM4E
SCHEMBL6137239 0.68 ALDH1A1 (0.43) GAATSHRALDH1A1CYP2C19HSD17B10
SCHEMBL6404733 0.66 ALDH1A1 (0.47) GAAALDH1A1CYP2C19KDM4E
SCHEMBL669693 0.65 HTR2C (0.50) GAA
SCHEMBL6399098 0.65 HDAC1 (0.49) GAAALDH1A1POLBCYP2C19KMT2A
SCHEMBL30023288 0.64 GAA (0.57) GAAALDH1A1TNKS2KDM1AKDM1B
SCHEMBL11652329 0.64 GAA (0.57) GAAALDH1A1TNKS2KDM1AKDM1B

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-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US claimed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP claimed
US-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US disclosed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 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-20050054696-A1 Indole compounds and medicinal use thereof IDO1, GPR119, SLC5A1 GAA 1100/4885TSHR 1304/4885KCNN4 1273/4885

“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.