SCHEMBL18038998

SCHEMBL18038998

O=C(Cn1cc(S(=O)(=O)N2CCCCCC2)ccc1=O)c1ccc(-c2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HTT P42858 1/20 0.45
▸ APOBEC3A P31941 1/20 0.45
▸ APOBEC3G Q9HC16 1/20 0.45
▸ MAPT P10636 4/20 0.44
▸ POLB P06746 1/20 0.44
▸ LMNA P02545 5/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ATM Q13315 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ TSHR P16473 2/20 0.43
▸ TP53 P04637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42

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
SCHEMBL18038967 0.99 GAA (0.47) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL30207105 0.99 GAA (0.47) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL18038984 0.91 HTT (0.48) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL18038982 0.91 HTT (0.52) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL18038966 0.90 HTT (0.52) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL22050495 0.89 GAA (0.44) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL21749683 0.88 GAA (0.46) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL22051931 0.88 GAA (0.42) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL18038965 0.88 L3MBTL1 (0.52) GAACYP1A2CYP2D6PKMCYP2C19
SCHEMBL22050826 0.88 GAA (0.45) GAACYP1A2CYP2D6PKMCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11311523-B2 Pyridinone compound and use thereof KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2022-04-26 — — US disclosed
EP-3692992-A1 METHOD OF SCREENING DOCK1-SELECTIVE INHIBITORS FOR CANCER TREATMENT Kyushu University National University Corporation (JP) 2020-08-12 — — EP disclosed
EP-3263133-B1 PYRIDINONE COMPOUND AND USE THEREOF UNIV KYUSHU NAT UNIV CORP (JP) 2020-04-01 — — EP disclosed
US-20200061039-A1 PYRIDINONE COMPOUND AND USE THEREOF KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2020-02-27 — — US disclosed
US-10406141-B2 Pyridinone compound and use thereof KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2019-09-10 — — US disclosed
US-20180028515-A1 PYRIDINONE COMPOUND AND USE THEREOF KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-02-01 — — US disclosed
EP-3263133-A1 PYRIDINONE COMPOUND AND USE THEREOF Kyushu University, National University Corporation (JP) 2018-01-03 — — EP disclosed
WO-2016136985-A1 PYRIDINONE COMPOUND AND USE THEREOF 国立大学法人九州大学 2016-09-01 — — 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 (4 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-20180028515-A1 PYRIDINONE COMPOUND AND USE THEREOF DOCK5, DOCK2, CIB1 GAA 4692/4885CYP1A2 2087/4885CYP2D6 1497/4885
US-20200061039-A1 PYRIDINONE COMPOUND AND USE THEREOF DOCK5, DOCK2, CIB1 GAA 4691/4885CYP1A2 2070/4885CYP2D6 1491/4885
US-10406141-B2 Pyridinone compound and use thereof DOCK5, DOCK2, CIB1 GAA 4692/4885CYP1A2 2087/4885CYP2D6 1497/4885
US-11311523-B2 Pyridinone compound and use thereof DOCK5, DOCK2, CIB1 GAA 4691/4885CYP1A2 2070/4885CYP2D6 1491/4885

“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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