SCHEMBL8740013

SCHEMBL8740013

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

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.55
▸ CYP3A4 P08684 2/20 0.55
▸ TSHR P16473 2/20 0.46
▸ FFAR1 O14842 1/20 0.42
▸ HTR7 P34969 2/20 0.41
▸ CA12 O43570 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA6 P23280 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HPGDS O60760 1/20 0.39
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ OPRK1 P41145 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ CA5A P35218 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.38
▸ CA5B Q9Y2D0 1/20 0.38

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
SCHEMBL24777730 0.89 ALDH1A1 (0.45) ALDH1A1CYP3A4TSHRFFAR1HTR7
SCHEMBL2135627 0.83 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRHTR7HSD17B10
SCHEMBL342130 0.81 ALDH1A1 (0.58) ALDH1A1CYP3A4TSHRCA12CA2
SCHEMBL29415443 0.81 RAB9A (0.46) ALDH1A1CYP3A4FFAR1LMNAMAPT
SCHEMBL11879900 0.81 FFAR1 (0.43) ALDH1A1CYP3A4TSHRFFAR1THRA
SCHEMBL22716240 0.81 FOLH1 (0.39) ALDH1A1TSHRFFAR1THRATHRB
SCHEMBL2808540 0.81 PTPN1 (0.46) ALDH1A1CA12CA2CA9CA1
SCHEMBL2808504 0.81 RAB9A (0.46) ALDH1A1CYP3A4FFAR1LMNAMAPT
SCHEMBL2804456 0.81 SMN1; SMN2 (0.47) ALDH1A1CYP3A4TSHRFFAR1LMNA
SCHEMBL8740014 0.80 ALDH1A1 (0.56) ALDH1A1CYP3A4TSHRCA12CA2

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 7 patents. 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
EP-4031247-A1 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE Novartis AG (CH) 2022-07-27 — — EP disclosed
CN-114521196-A Bifunctional group degradation agent and use method thereof 诺华股份有限公司 2022-05-20 — — CN disclosed
WO-2021053495-A1 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-03-25 — — WO disclosed
US-9701667-B2 Coumarin-based fluorogenic agents and uses thereof for specific protein labelling UNIVERSITY OF OTTAWA (CA) 2017-07-11 — — US disclosed
US-20150316557-A1 COUMARIN-BASED FLUOROGENIC AGENTS AND USES THEREOF FOR SPECIFIC PROTEIN LABELLING UNIVERSITY OF OTTAWA (CA) 2015-11-05 — — US disclosed
US-5668260-A Tetrakisazo Compounds, the method of preparation thereof and the process of pyeing HOECHT AKTIENGE SELLSCHAFT (DE) 1997-09-16 — — 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 (2 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 2539/4885TSHR 2854/4885
US-20150316557-A1 COUMARIN-BASED FLUOROGENIC AGENTS AND USES THEREOF FOR SPECIFIC PROTEIN LABELLING PFDN1, PFDN6, CDC73 ALDH1A1 1274/4885CYP3A4 399/4885TSHR 4815/4885

“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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