SCHEMBL22288656

SCHEMBL22288656

CC(=O)Nc1cnc(-n2nccn2)c(C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 11/20 0.43
MYC P01106 1/20 0.43
OPRK1 P41145 1/20 0.42
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 1/20 0.37
RORC P51449 1/20 0.37
JAK2 O60674 1/20 0.37

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
SCHEMBL1672068 0.79 MYC (0.63) MYCMAPTPOLBKDM4EKMT2A
SCHEMBL1672011 0.76 HCRTR1 (0.45) MYCKDM4E
SCHEMBL8567074 0.76 KMT2A (0.44) MYCOPRK1MAPTKDM4EKMT2A
SCHEMBL29424909 0.74 MYC (0.41) MYCKDM4EKMT2A
SCHEMBL30361760 0.73 KDM4E (0.43) MALT1MYCOPRK1KDM4E
SCHEMBL29424961 0.73 GABRP (0.39) OPRK1MAPTPOLBTDP1KDM4E
SCHEMBL19480838 0.73 ALDH1A1 (0.39) MALT1OPRK1MAPTKDM4E
SCHEMBL19472425 0.73 KDM4E (0.43) MALT1MYCOPRK1KDM4E
SCHEMBL30361654 0.73 ALDH1A1 (0.39) MALT1OPRK1MAPTKDM4E
SCHEMBL19480698 0.73 KDM4E (0.43) MAPTPOLBTDP1KDM4EKMT2A

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-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
WO-2020157474-A1 OREXIN 1 RECEPTOR ANTAGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2020-08-06 WO disclosed
WO-2020157474-A1 OREXIN 1 RECEPTOR ANTAGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2020-08-06 WO 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 MALT1 2073/4885MYC 4583/4885OPRK1 28/4885
US-12240825-B2 Oxexin 1 receptor antagonists HCRTR1, HCRTR2, OXTR MALT1 2073/4885MYC 4583/4885OPRK1 28/4885

“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.