SCHEMBL18038995

SCHEMBL18038995

O=C(Cn1cc(S(=O)(=O)N2CCCCCC2)ccc1=O)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ POLB P06746 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NSD2 O96028 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ HSD17B10 Q99714 1/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ HPGD P15428 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ MAPT P10636 1/20 0.45

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
SCHEMBL18038949 0.99 GAA (0.50) ALDH1A1POLBGAAHTTMAPK1
SCHEMBL18038989 0.89 L3MBTL1 (0.56) ALDH1A1POLBGAALMNAL3MBTL1
SCHEMBL18038959 0.89 L3MBTL1 (0.56) ALDH1A1POLBGAALMNAL3MBTL1
SCHEMBL18038954 0.89 L3MBTL1 (0.56) ALDH1A1POLBGAALMNAL3MBTL1
SCHEMBL18038957 0.89 ALDH1A1 (0.46) ALDH1A1POLBGAAHTTMAPK1
SCHEMBL18039017 0.88 POLB (0.51) ALDH1A1POLBGAAL3MBTL1TP53
SCHEMBL18038968 0.88 PKM (0.56) ALDH1A1POLBHTTMAPK1LMNA
SCHEMBL18039011 0.88 ALDH1A1 (0.44) ALDH1A1POLBGAAHTTMAPK1
SCHEMBL18038982 0.86 HTT (0.52) ALDH1A1POLBGAAHTTLMNA
SCHEMBL18038944 0.86 AKR1C3 (0.51) ALDH1A1POLBGAAHTTLMNA

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 ALDH1A1 52/4885POLB 3980/4885GAA 4692/4885
US-20200061039-A1 PYRIDINONE COMPOUND AND USE THEREOF DOCK5, DOCK2, CIB1 ALDH1A1 49/4885POLB 3993/4885GAA 4691/4885
US-10406141-B2 Pyridinone compound and use thereof DOCK5, DOCK2, CIB1 ALDH1A1 52/4885POLB 3980/4885GAA 4692/4885
US-11311523-B2 Pyridinone compound and use thereof DOCK5, DOCK2, CIB1 ALDH1A1 49/4885POLB 3993/4885GAA 4691/4885

“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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