SCHEMBL20323150

SCHEMBL20323150

C=C1CC2(OC1=O)C(=O)Nc1ccccc12

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ PDK2 Q15119 1/20 0.43
▸ PDK4 Q16654 1/20 0.43
▸ LMNA P02545 3/20 0.41
▸ BACE1 P56817 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ EGFR P00533 1/20 0.39
▸ HTR6 P50406 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ NPSR1 Q6W5P4 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
SCHEMBL23832817 0.77 PDK2 (0.44) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL28562087 0.76 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL1520018 0.75 ALDH1A1 (0.61) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL1520522 0.72 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL18981138 0.72 EGFR (0.57) ALDH1A1KMT2AMEN1GAALMNA
SCHEMBL1520717 0.70 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL15703418 0.69 POLB (0.40) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL28375510 0.69 MEN1 (0.61) ALDH1A1KMT2AMEN1POLBGAA
Fluoride SCHEMBL28908418 0.69 MEN1 (0.61) ALDH1A1KMT2AMEN1POLBGAA
SCHEMBL28565197 0.69 LMNA (0.46) ALDH1A1KMT2AMEN1POLBGAA

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-11840540-B2 Dimers of covalent NFKB inhibitors BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2023-12-12 — — US disclosed
US-11840540-B2 Dimers of covalent NFKB inhibitors BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2023-12-12 — — US disclosed
US-20230174548-A1 SYMBIOTIC PRODRUGS FOR THE TREATMENT OF CANCER AND OTHER DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-06-08 — — US disclosed
US-20220009941-A1 Dimers of Covalent NFKB Inhibitors BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA 2022-01-13 — — US disclosed
WO-2021188855-A1 SYMBIOTIC PRODRUGS FOR THE TREATMENT OF CANCER AND OTHER DISEASES BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2021-09-23 — — WO disclosed
US-20190322680-A1 Dimers of Covalent NFKB Inhibitors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-10-24 — — US disclosed
WO-2018119177-A1 DIMERS OF COVALENT NFKB INHIBITORS BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2018-06-28 — — 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-20220009941-A1 Dimers of Covalent NFKB Inhibitors NFKBIA, IKBKB, NFKB2 ALDH1A1 3908/4885KMT2A 1133/4885MEN1 3932/4885
US-20230174548-A1 SYMBIOTIC PRODRUGS FOR THE TREATMENT OF CANCER AND OTHER DISEASES NFKBIA, NFRKB, IKBKB ALDH1A1 2443/4885KMT2A 2742/4885MEN1 3329/4885
US-11840540-B2 Dimers of covalent NFKB inhibitors NFKBIA, IKBKB, NFKB2 ALDH1A1 3908/4885KMT2A 1133/4885MEN1 3932/4885
US-20190322680-A1 Dimers of Covalent NFKB Inhibitors NFKBIA, IKBKB, NFKB2 ALDH1A1 4048/4885KMT2A 1190/4885MEN1 3911/4885

“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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