SCHEMBL24252034

SCHEMBL24252034

CCNC(=O)c1cccc(C(C)(C)C)c1OC

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.58
CTSS P25774 1/20 0.49
HPGD P15428 1/20 0.47
LMNA P02545 2/20 0.43
APEX1 P27695 4/20 0.43
DRD2 P14416 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NLRP3 Q96P20 1/20 0.39

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
SCHEMBL8609341 0.85 NR1H4 (0.55) NR1H4CTSSHPGDLMNAAPEX1
SCHEMBL24252069 0.83 NR1H4 (0.59) NR1H4CTSSHPGDAPEX1JAK1
SCHEMBL17207245 0.81 LMNA (0.53) HPGDLMNAAPEX1DRD2JAK1
SCHEMBL7223846 0.81 L3MBTL1 (0.49) HPGDLMNAKMT2AL3MBTL1ALDH1A1
SCHEMBL27747787 0.80 HPGD (0.69) HPGDLMNAKMT2AMEN1L3MBTL1
SCHEMBL24252036 0.79 CTSS (0.47) CTSSHPGDLMNAKMT2AL3MBTL1
SCHEMBL22059503 0.79 HPGD (0.49) CTSSHPGDLMNAAPEX1DRD2
SCHEMBL30739874 0.79 HPGD (0.49) CTSSHPGDLMNAAPEX1DRD2
SCHEMBL7796386 0.78 NR1H4 (0.56) NR1H4CTSSHPGDAPEX1ALDH1A1
SCHEMBL1601264 0.77 NR1H4 (0.53) NR1H4KMT2AMEN1L3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220048915-A1 Nitrogen-containing Heterocyclic Compound and Composition Thereof, Preparation Method Therefor, and Application Thereof SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2022-02-17 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-20220048915-A1 Nitrogen-containing Heterocyclic Compound and Composition Thereof, Preparation Method Therefor, and Application Thereof MAPK11, WEE1, NOS1 NR1H4 1506/4885CTSS 4371/4885HPGD 190/4885

“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.