SCHEMBL13640847

SCHEMBL13640847

COCCONC(=O)COCCOCCNC(=O)CCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ GLP1R P43220 8/20 0.42
▸ EPHX2 P34913 4/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ CNR1 P21554 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
SCHEMBL15259316 0.91 TSHR (0.49) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL13165265 0.88 TSHR (0.49) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL13641016 0.88 TSHR (0.49) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL13640790 0.88 TSHR (0.49) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL20151931 0.88 ALDH1A1 (0.55) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL12673953 0.88 ALDH1A1 (0.55) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL11921661 0.88 ALDH1A1 (0.55) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL18923938 0.85 TSHR (0.56) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL18923980 0.85 TSHR (0.56) HPGDHTTSMN1; SMN2TSHRALDH1A1
SCHEMBL15257829 0.85 GLP1R (0.45) HPGDHTTSMN1; SMN2TSHRALDH1A1

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-9012398-B2 Acylated exendin-4 compounds NOVO NORDISK A/S (DK) 2015-04-21 — — US disclosed
US-20120283170-A1 Acylated Exendin-4 Compounds NOVO NORDISK A/S (DK) 2012-11-08 — — 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-20120283170-A1 Acylated Exendin-4 Compounds GLP1R, VIP, IAPP HPGD 2879/4885HTT 167/4885SMN1; SMN2 3411/4885

“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.

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