SCHEMBL6153842

SCHEMBL6153842

C=CCOC(=O)CC1CNCCC1=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.34
TSHR P16473 2/20 0.33
ALDH1A1 P00352 4/20 0.32
GAA P10253 1/20 0.32
KDM4E B2RXH2 2/20 0.31
HPGD P15428 2/20 0.31
HSD17B10 Q99714 2/20 0.31
CYP3A4 P08684 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL6154775 0.77 TSHR (0.34) TSHRALDH1A1GAAKDM4EHPGD
SCHEMBL11795168 0.77 ALDH1A1 (0.42) NPSR1TSHRALDH1A1GAAKDM4E
SCHEMBL25072325 0.74 DDB1 (0.34) GAA
SCHEMBL3623641 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL1478256 0.73 SLC6A1 (0.46) TSHRKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL28790221 0.72 SLC6A12 (0.44) TSHRKDM4E
SCHEMBL15011338 0.68 POLB (0.41) TSHRALDH1A1HSD17B10PKMSMN1; SMN2
SCHEMBL9199145 0.68
SCHEMBL27603777 0.67
SCHEMBL27741990 0.67

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-6841562-B2 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor AVENTIS PHARMA S.A. (FR) 2005-01-11 US disclosed
US-20040082610-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor NOVEXEL (FR) 2004-04-29 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-20040082610-A1 Quinolylpropylpiperidine derivatives, intermediates and compositions containing them, and preparation therefor RRS1, MRPL21, FARSB NPSR1 2953/4885TSHR 2967/4885ALDH1A1 1452/4885

“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.