SCHEMBL25544202

SCHEMBL25544202

Cc1cc(Cl)ccc1COc1cccc(N)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.50
MAOB P27338 3/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.47
APP P05067 1/20 0.47
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
TSHR P16473 1/20 0.44
DHFR P00374 1/20 0.43
DCPS Q96C86 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MAOA P21397 2/20 0.42
HPD P32754 2/20 0.41
HTR6 P50406 1/20 0.41
INPPL1 O15357 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
CDK4 P11802 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
SCHEMBL4638817 0.82 MAOB (0.53) CYP3A4MAOBTP53CYP1A2APP
SCHEMBL31172168 0.81 MAOB (0.60) CYP3A4MAOBTP53APPTSHR
SCHEMBL4638503 0.81 MAOB (0.60) CYP3A4MAOBTP53APPTSHR
SCHEMBL4638746 0.76 MAOB (0.72) CYP3A4MAOBTP53CYP1A2APP
SCHEMBL11091408 0.75 MAOB (0.56) CYP3A4MAOBTP53CYP1A2APP
SCHEMBL14860962 0.75 MAOB (0.70) CYP3A4MAOBAPPNR4A2DHFR
SCHEMBL4638867 0.75 MAOB (0.60) CYP3A4MAOBTP53CYP1A2APP
SCHEMBL4638185 0.75 CYP3A4 (0.51) CYP3A4MAOBTP53CYP1A2APP
SCHEMBL4639060 0.74 CYP2A6 (0.54) CYP3A4MAOBTP53CYP1A2APP
SCHEMBL4638512 0.73 MAOB (0.50) CYP3A4MAOBTP53CYP1A2APP

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-20230165846-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-06-01 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-20230165846-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR CYP3A4 1043/4885MAOB 2452/4885TP53 4121/4885

“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.