SCHEMBL3606499

SCHEMBL3606499

CCc1c(CCN)ccc(C(N)=O)c1CC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.38
HMGB1 P09429 1/20 0.37
TAAR1 Q96RJ0 5/20 0.36
HTR1A P08908 4/20 0.35
HTR1D P28221 3/20 0.35
HTR2C P28335 3/20 0.35
HTR1B P28222 3/20 0.35
HTR7 P34969 2/20 0.35
HTR5A P47898 2/20 0.35
HTR6 P50406 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PARP1 P09874 2/20 0.33
DGAT1 O75907 1/20 0.33
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
CDC7 O00311 1/20 0.31

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
SCHEMBL5619271 0.88 PRKCI (0.38) MEN1KMT2AHSD17B10PARP1CCNC
SCHEMBL5618594 0.87 PARP1 (0.38) MEN1TSHRKMT2AHSD17B10PARP1
Hydrochloric Acid SCHEMBL10630450 0.85 PARP1 (0.37) MEN1TSHRKMT2AHSD17B10PARP1
Bromide SCHEMBL9317974 0.85 PARP1 (0.37) MEN1TSHRKMT2AHSD17B10PARP1
SCHEMBL1018547 0.83 PARP1 (0.42) MEN1TSHRKMT2AHSD17B10PARP1
SCHEMBL2399438 0.82 MEN1 (0.43) MEN1TSHRKMT2ALMNAADRA2A
SCHEMBL30824614 0.77 DGAT1 (0.41) BACE1HMGB1TAAR1HTR1AHTR1D
SCHEMBL28252973 0.77 DGAT1 (0.41) BACE1HMGB1TAAR1HTR1AHTR1D
SCHEMBL4155497 0.77 PKM (0.36) MEN1CYP1A2TSHRKMT2AHSD17B10
SCHEMBL59737 0.77 NNMT (0.36) MEN1TSHRKMT2AHSD17B10PARP1

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-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP BACE1 30/4885HMGB1 1197/4885TAAR1 3496/4885

“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.