SCHEMBL23329976

SCHEMBL23329976

CC(C)NCc1ccccc1-c1ccc(CN)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 3/20 0.45
DPP4 P27487 1/20 0.44
TAAR1 Q96RJ0 2/20 0.43
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
HRH3 Q9Y5N1 1/20 0.39
BACE1 P56817 3/20 0.39
HRH1 P35367 1/20 0.39
PARP1 P09874 2/20 0.38
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
CSNK2A3 Q8NEV1 1/20 0.37
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
AKT2 P31751 1/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
ADRB2 P07550 1/20 0.36
F10 P00742 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
SCHEMBL23329978 0.87 HTR7 (0.42) CD274DPP4BCHEACHEHRH1
SCHEMBL23347265 0.86 LMNA (0.38) CD274DPP4TAAR1BCHEACHE
SCHEMBL13164328 0.83 HRH1 (0.53) CD274DPP4BCHEACHEHRH1
SCHEMBL31311016 0.83 HRH1 (0.53) CD274DPP4BCHEACHEHRH1
SCHEMBL23229977 0.82 DPP4 (0.48) CD274DPP4TAAR1HRH3CSNK2A2
SCHEMBL23330222 0.82 DPP4 (0.48) CD274DPP4BCHEACHEHRH1
SCHEMBL23330219 0.81 BCHE (0.41) CD274BCHEACHEHRH1FFAR1
SCHEMBL23330752 0.78 KCNA5 (0.47) CD274BCHEACHEHRH1F10
SCHEMBL3789431 0.77 DPP4 (0.72) CD274DPP4TAAR1HRH3CSNK2A2
SCHEMBL22400162 0.76 CSNK2A1 (0.58) CD274DPP4TAAR1HRH3CSNK2A2

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-20210130473-A1 TGFßR1 INHIBITOR-ASGR ANTIBODY CONJUGATES AND USES THEREOF SILVERBACK THERAPEUTICS, INC. 2021-05-06 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-20210130473-A1 TGFßR1 INHIBITOR-ASGR ANTIBODY CONJUGATES AND USES THEREOF TGFBR2, ASGR1, TGFBR1 CD274 368/4885DPP4 4107/4885TAAR1 578/4885

“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.