SCHEMBL29424909

SCHEMBL29424909

CC(=O)Nc1cc(F)c(-n2nccn2)c(C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.41
KDM4E B2RXH2 4/20 0.37
LMNA P02545 1/20 0.37
IDO1 P14902 2/20 0.36
TDO2 P48775 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
HDAC1 Q13547 2/20 0.35
KMT2A Q03164 1/20 0.34
PDE10A Q9Y233 1/20 0.34
HSD17B10 Q99714 2/20 0.34
NAPRT Q6XQN6 1/20 0.34
GAA P10253 1/20 0.34
MAP2K1 Q02750 1/20 0.34
EGLN2 Q96KS0 2/20 0.33
ASPH Q12797 1/20 0.33
KDM8 Q8N371 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
BACE1 P56817 1/20 0.33
PREP P48147 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
SCHEMBL16277496 0.79 MYC (0.43) MYCKDM4EASPHKDM8KEAP1
SCHEMBL16277625 0.79 HCRTR1 (0.42) KDM4ELMNAKMT2AHSD17B10NAPRT
SCHEMBL29628827 0.79 HCRTR1 (0.42) KDM4ELMNAKMT2AHSD17B10NAPRT
SCHEMBL1672068 0.74 MYC (0.63) MYCKDM4ESMN1; SMN2KMT2APDE10A
SCHEMBL22288656 0.74 MALT1 (0.43) MYCKDM4EKMT2A
SCHEMBL1966151 0.69 HDAC1 (0.58) MYCKDM4ESMN1; SMN2HDAC1KMT2A
SCHEMBL1655468 0.69 MYC (0.56) MYCKDM4ESMN1; SMN2HDAC1KMT2A
SCHEMBL16463711 0.69 HCRTR1 (0.39) KDM4EASPHKDM8KEAP1
SCHEMBL1586067 0.68 ALB (0.50) NAPRT
SCHEMBL29628873 0.68 ALB (0.50) NAPRT

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-12240825-B2 Oxexin 1 receptor antagonists NXERA PHARMA UK LIMITED (GB) 2025-03-04 US disclosed
US-20220098165-A1 OXEXIN 1 RECEPTOR ANTAGONISTS NXERA PHARMA UK LIMITED (GB) 2022-03-31 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 (2 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-20220098165-A1 OXEXIN 1 RECEPTOR ANTAGONISTS HCRTR1, HCRTR2, OXTR MYC 4583/4885KDM4E 1658/4885LMNA 4030/4885
US-12240825-B2 Oxexin 1 receptor antagonists HCRTR1, HCRTR2, OXTR MYC 4583/4885KDM4E 1658/4885LMNA 4030/4885

“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.