SCHEMBL24777730

SCHEMBL24777730

O=C(O)CCN(CCC(O)O)c1cccc(O)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HPGDS O60760 1/20 0.41
▸ TSHR P16473 1/20 0.38
▸ HTR7 P34969 2/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ NAALAD2 Q9Y3Q0 3/20 0.35
▸ CSF3R Q99062 1/20 0.35
▸ KYNU Q16719 1/20 0.35
▸ MEP1B Q16820 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA6 P23280 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ GGH Q92820 1/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL8740013 0.89 ALDH1A1 (0.55) ALDH1A1CYP3A4HPGDSTSHRHTR7
SCHEMBL2135627 0.75 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRHTR7
SCHEMBL8084726 0.73 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRHTR7CA12
SCHEMBL342130 0.73 ALDH1A1 (0.58) ALDH1A1CYP3A4TSHRKDM4ECA12
SCHEMBL2808504 0.72 RAB9A (0.46) ALDH1A1CYP3A4FFAR1
SCHEMBL22716240 0.72 FOLH1 (0.39) ALDH1A1TSHRFFAR1
SCHEMBL11879900 0.72 FFAR1 (0.43) ALDH1A1CYP3A4TSHRFFAR1
SCHEMBL2808540 0.72 PTPN1 (0.46) ALDH1A1MEP1BCA12CA1CA2
SCHEMBL29415443 0.72 RAB9A (0.46) ALDH1A1CYP3A4FFAR1
SCHEMBL2804456 0.72 SMN1; SMN2 (0.47) ALDH1A1CYP3A4TSHRFFAR1

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-20220387602-A1 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE NOVARTIS AG (CH) 2022-12-08 — — 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-20220387602-A1 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE JMJD7, MDM2, IDE ALDH1A1 2189/4885CYP3A4 2539/4885HPGDS 1343/4885

“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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