SCHEMBL22184191

SCHEMBL22184191

CC(C)[C@H](NC(=O)CCCCCN1C(=O)CCC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ NOD1 Q9Y239 4/20 0.39
▸ EPHX2 P34913 2/20 0.38
▸ C3AR1 Q16581 1/20 0.38
▸ FNTA P49354 1/20 0.37
▸ FNTB P49356 1/20 0.37
▸ FURIN P09958 3/20 0.36
▸ CTSL P07711 1/20 0.36
▸ CTDSP1 Q9GZU7 1/20 0.36
▸ NMT2 O60551 1/20 0.36
▸ NMT1 P30419 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
SCHEMBL24141113 0.93 SMN1; SMN2 (0.44) SMN1; SMN2HPGDHTTALDH1A1POLB
SCHEMBL15870198 0.93 SMN1; SMN2 (0.43) SMN1; SMN2HPGDHTTALDH1A1POLB
SCHEMBL21120393 0.92 SMN1; SMN2 (0.43) SMN1; SMN2HPGDHTTALDH1A1POLB
SCHEMBL17993320 0.92 SMN1; SMN2 (0.43) SMN1; SMN2HPGDHTTALDH1A1POLB
SCHEMBL28051813 0.89 C3AR1 (0.40) POLBNOD1EPHX2C3AR1FNTA
SCHEMBL2801888 0.89 C3AR1 (0.40) POLBNOD1EPHX2C3AR1FNTA
SCHEMBL22134344 0.89 C3AR1 (0.40) POLBNOD1EPHX2C3AR1FNTA
SCHEMBL16925642 0.89 C3AR1 (0.40) POLBNOD1EPHX2C3AR1FNTA
SCHEMBL19776914 0.86 FNTA (0.40) POLBNOD1EPHX2C3AR1FNTA
SCHEMBL2715793 0.84 NMT2 (0.49) NOD1EPHX2C3AR1FNTAFNTB

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
EP-3630732-B1 METHOD AND MOLECULES MEDIMMUNE LLC (US) 2023-07-12 — — EP disclosed
US-20200206359-A1 Method And Molecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-07-02 — — 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-20200206359-A1 Method And Molecules PAICS, EPCAM, SQLE SMN1; SMN2 3495/4885HPGD 668/4885HTT 4153/4885

“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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