SCHEMBL22501665

SCHEMBL22501665

O=C(O)NCc1cccc(-c2ncco2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.52
▸ AOC3 Q16853 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ HPGDS O60760 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ KDM4C Q9H3R0 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ CARM1 Q86X55 1/20 0.41
▸ HCRTR1 O43613 1/20 0.41
▸ HCRTR2 O43614 1/20 0.41

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
SCHEMBL22501724 0.79 HPGDS (0.50) MAPK1AOC3CYP1A2CYP2D6CYP2C9
SCHEMBL1804513 0.78 PRKCI (0.53) MAPK1HPGDSHCRTR1HCRTR2CYP3A4
SCHEMBL25488454 0.78 MAPK1 (0.43) MAPK1HPGDSHCRTR1HCRTR2CYP3A4
SCHEMBL9507339 0.77 HPGDS (0.53) CYP1A2CYP2C19HPGDSHDAC4HCRTR1
SCHEMBL12469027 0.76 SMN1; SMN2 (0.57) MAPK1ALDH1A1CYP1A2TSHRCYP2C19
SCHEMBL6221648 0.76 HPGDS (0.44) MAPK1HPGDSHDAC4HCRTR1HCRTR2
SCHEMBL22501609 0.76 PRMT6 (0.62) MAPK1AOC3CYP2D6CYP2C9KDM4C
SCHEMBL9863754 0.75 HPGDS (0.46) MAPK1TSHRHPGDSHCRTR1HCRTR2
SCHEMBL9454674 0.75 HPGDS (0.46) MAPK1ALDH1A1TSHRHPGDSHCRTR1
SCHEMBL12648428 0.75 NOTUM (0.50) MAPK1ALDH1A1HPGDHPGDSMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11945806-B2 Stabilization of amyloidogenic immunoglobulin light chains THE SCRIPPS RESEARCH INSTITUTE 2024-04-02 — — US disclosed
US-20220204485-A1 STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS THE SCRIPPS RESEARCH INSTITUTE 2022-06-30 — — US disclosed
EP-3946604-A1 BENZOPYRANE AND IMIDAZOLE DERIVATIVES USEFUL FOR THE STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS The Scripps Research Institute (US) 2022-02-09 — — EP disclosed
WO-2020205683-A1 BENZOPYRANE AND IMIDAZOLE DERIVATIVES USEFUL FOR THE STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS THE SCRIPPS RESEARCH INSTITUTE (US) 2020-10-08 — — WO 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-20220204485-A1 STABILIZATION OF AMYLOIDOGENIC IMMUNOGLOBULIN LIGHT CHAINS TTR, MAP1LC3B, SAAL1 MAPK1 1900/4885AOC3 3864/4885ALDH1A1 2072/4885
US-11945806-B2 Stabilization of amyloidogenic immunoglobulin light chains TTR, MAP1LC3B, SAAL1 MAPK1 1900/4885AOC3 3864/4885ALDH1A1 2072/4885

“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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