SCHEMBL24796027

SCHEMBL24796027

O=C(CSCC(=O)NCC1CCC1)NCCN1C(=O)C[C@@H](O)C1=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ RAB9A P51151 3/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ MITF O75030 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ MDM2 Q00987 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL24796402 0.87 CYP1A2 (0.38) CYP1A2CYP3A4ALDH1A1KMT2ARAB9A
SCHEMBL24796658 0.87 CYP1A2 (0.38) CYP1A2CYP3A4ALDH1A1KMT2ARAB9A
SCHEMBL24796674 0.85 CYP1A2 (0.36) CYP1A2CYP3A4ALDH1A1KMT2ARAB9A
SCHEMBL24796137 0.85 CYP1A2 (0.39) CYP1A2CYP3A4ALDH1A1KMT2ARAB9A
SCHEMBL21389368 0.84 CYP1A2 (0.36) CYP1A2CYP3A4ALDH1A1KMT2ARAB9A
SCHEMBL21389478 0.84 HTT (0.44) CYP1A2CYP3A4ALDH1A1KMT2ARAB9A
SCHEMBL21383848 0.84 FABP3 (0.37) ALDH1A1KMT2AL3MBTL1MITFLMNA
SCHEMBL26634654 0.84 FABP3 (0.37) ALDH1A1KMT2AL3MBTL1MITFLMNA
SCHEMBL26634655 0.84 FABP3 (0.37) ALDH1A1KMT2AL3MBTL1MITFLMNA
SCHEMBL24796675 0.84 HPGD (0.43) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1

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-11535660-B1 Modulators of G-protein coupled receptors Cannot Therapeutics, Inc. (US) 2022-12-27 — — 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-11535660-B1 Modulators of G-protein coupled receptors GIPR, GLP1R, GCGR CYP1A2 4309/4885CYP3A4 4044/4885ALDH1A1 3367/4885

“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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