SCHEMBL4883328

SCHEMBL4883328

CCc1nc(CCOCc2ccccc2)n(CC)c1Sc1cc(Cl)cc(C#N)c1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
GHSR Q92847 2/20 0.32
POLB P06746 1/20 0.32
ADRB2 P07550 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GRM5 P41594 2/20 0.32
MAOB P27338 2/20 0.31
MAOA P21397 1/20 0.31
KCNH2 Q12809 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NOS2 P35228 1/20 0.30

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
SCHEMBL4890931 0.94 TSHR (0.35) TSHRGHSRMAOBMAOAMEN1
SCHEMBL14154011 0.90 TSHR (0.33) TSHRGHSRMAOBMAOAALDH1A1
SCHEMBL4875980 0.87 TSHR (0.33) TSHRPOLBADRB2HTTSMN1; SMN2
SCHEMBL4899994 0.85 TSHR (0.37) TSHRGHSRMAOBMAOAMEN1
SCHEMBL4892334 0.84 ALDH1A1 (0.34) TSHRGHSRMAOBMAOAALDH1A1
SCHEMBL4902955 0.82 TLR7 (0.32) TSHR
SCHEMBL4882617 0.81 KCNH2 (0.34) KCNH2
SCHEMBL14108423 0.81 KCNH2 (0.34) KCNH2
SCHEMBL4903034 0.80 NOS2 (0.36) TSHRMAOBMAOAMEN1KMT2A
SCHEMBL4902928 0.80 TSHR (0.36) TSHRMAOBMAOAMEN1KMT2A

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-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators PFIZER INC 2008-07-24 US disclosed
US-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators PFIZER INC 2008-07-24 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-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators POLRMT, POLR1G, POLR2A TSHR 1981/4885GHSR 4113/4885POLB 13/4885

“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.