SCHEMBL2845918

SCHEMBL2845918

CC(C)(C)C(=O)NCCC=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
CA3 P07451 2/20 0.38
CA5A P35218 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
KDM4E B2RXH2 3/20 0.35
MAPT P10636 1/20 0.35
TP53 P04637 1/20 0.34
ALDH1A1 P00352 3/20 0.33
DRD4 P21917 3/20 0.33
DRD2 P14416 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 2/20 0.33
CA14 Q9ULX7 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CA12 O43570 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA9 Q16790 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL260600 0.87 POLB (0.47) POLBCA3CA5ACA5BKDM4E
SCHEMBL6446695 0.85 POLB (0.46) POLBCA3CA5ACA5BKDM4E
SCHEMBL16316312 0.85 POLB (0.50) POLBCA3CA5ACA5BKDM4E
SCHEMBL7292154 0.84 MEN1 (0.45) POLBCA3CA5ACA5BKDM4E
SCHEMBL2843695 0.79 CA3 (0.33) CA3CA5ACA5B
SCHEMBL21992376 0.78 POLB (0.46) POLBCA3CA5ACA5BKDM4E
SCHEMBL989637 0.77 CA3 (0.63) POLBCA3CA5ACA5BALDH1A1
SCHEMBL3478019 0.77 CA3 (0.42) POLBCA3CA5ACA5BKDM4E
SCHEMBL26161761 0.77 EPHX1 (0.48) POLBCA3CA5ACA5BKDM4E
SCHEMBL10175006 0.77 CNR1 (0.33) CA3CA5ACA5BCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11639335-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2023-05-02 US disclosed
US-20220064118-A1 Asymmetric Bisaminoquinolines And Bisaminoquinolines With Varied Linkers As Autophagy Inhibitors For Cancer And Other Therapy NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-03 US disclosed
EP-3848355-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY The Trustees Of The University Of Pennsylvania (US) 2021-07-14 EP disclosed
US-11001558-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-05-11 US disclosed
EP-3177595-B1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY UNIV PENNSYLVANIA (US) 2021-02-24 EP disclosed
US-20190248747-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2019-08-15 US disclosed
US-10221140-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2019-03-05 US disclosed
US-20170275252-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-09-28 US disclosed
EP-3177595-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY The Trustees Of The University Of Pennsylvania (US) 2017-06-14 EP disclosed
US-9573966-B2 Anti-cancer activity of novel bicyclic heterocycles KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2017-02-21 US disclosed
WO-2016022956-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-02-11 WO disclosed
EP-2152670-B1 BRIDGED SIX-MEMBERED RING COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2013-12-25 EP disclosed
US-8202885-B2 Bridged six-membered ring compounds ACTELION PHARMACEUTICALS LTD. (CH) 2012-06-19 US disclosed
US-20100130545-A1 BRIDGED SIX-MEMBERED RING COMPOUNDS IDORSIA PHARMACEUTICALS LTD (CH) 2010-05-27 US disclosed
EP-2152670-A1 BRIDGED SIX-MEMBERED RING COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2010-02-17 EP disclosed
WO-2008132679-A1 BRIDGED SIX-MEMBERED RING COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2008-11-06 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 (7 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-11639335-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy SQSTM1, ATG7, BECN1 POLB 2264/4885CA3 4750/4885CA5A 3099/4885
US-11001558-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy SQSTM1, ATG7, BECN1 POLB 2264/4885CA3 4750/4885CA5A 3099/4885
US-20220064118-A1 Asymmetric Bisaminoquinolines And Bisaminoquinolines With Varied Linkers As Autophagy Inhibitors For Cancer And Other Therapy SQSTM1, ATG7, BECN1 POLB 2264/4885CA3 4750/4885CA5A 3099/4885
US-20190248747-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY SQSTM1, ATG7, BECN1 POLB 2264/4885CA3 4750/4885CA5A 3099/4885
US-20170275252-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY SQSTM1, ATG7, BECN1 POLB 2264/4885CA3 4750/4885CA5A 3099/4885
US-10221140-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy SQSTM1, ATG7, BECN1 POLB 2264/4885CA3 4750/4885CA5A 3099/4885
US-20100130545-A1 BRIDGED SIX-MEMBERED RING COMPOUNDS CACNA1E, CACNA1B, CACNA1A POLB 2616/4885CA3 418/4885CA5A 703/4885

“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.