SCHEMBL5049959

SCHEMBL5049959

CC(C)(C)OC(=O)NC1(C(=O)NC(=O)NS(=O)(=O)c2ccccc2)CCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.40
FAAH O00519 3/20 0.39
CA1 P00915 2/20 0.39
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NLRP3 Q96P20 1/20 0.37
GHSR Q92847 1/20 0.37
PPARA Q07869 1/20 0.37
HSD11B1 P28845 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
TET3 O43151 1/20 0.36
KMT2A Q03164 1/20 0.36
FBXL19 Q6PCT2 1/20 0.36
CXXC5 Q7LFL8 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
SCHEMBL13791907 0.86 BCL2 (0.44) BCL2FAAHCA1CA12CA7
SCHEMBL4742047 0.83 LMNA (0.44) CA1CA12LMNAHTTALDH1A1
SCHEMBL8174947 0.81 FAAH (0.51) FAAHALDH1A1GHSRTRPV1
SCHEMBL25384603 0.76 FAAH (0.62) FAAHALDH1A1GHSRTRPV1
SCHEMBL5394506 0.75 CA1 (0.57) BCL2CA1CA12CA7CA14
SCHEMBL5049960 0.73 GAA (0.43) LMNAHTTALDH1A1CYP2C9CYP2C19
SCHEMBL14095471 0.73 EGFR (0.42) ALDH1A1KMT2AEGFRERBB2
SCHEMBL5049956 0.72 GHSR (0.37) FAAHCA1CA12CA7CA14
Toluene SCHEMBL28585498 0.70 CA12 (0.52) BCL2CA1CA12CA7CA14
SCHEMBL4400570 0.70 CTSB (0.56) FAAHCA1CA12CA7CA14

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-20080207528-A1 Administering derivatives of 4-(3-pyrrolidinyloxy)quinoline TAIGEN BIOTECHNOLOGY CO., LTD. (TW) 2008-08-28 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-20080207528-A1 Administering derivatives of 4-(3-pyrrolidinyloxy)quinoline GLS2, SLC10A1, UGT1A1 BCL2 3833/4885FAAH 2302/4885CA1 4273/4885

“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.