SCHEMBL3133669

SCHEMBL3133669

CC1CN2c3ccccc3CC3(C(=O)NC(=O)NC3=O)C2C(C)O1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
TOP2A P11388 1/20 0.52

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
SCHEMBL5618631 1.00 KDM4E (0.52) KDM4EALDH1A1TOP2A
SCHEMBL13269857 1.00 KDM4E (0.52) KDM4EALDH1A1TOP2A
SCHEMBL12725646 1.00 KDM4E (0.52) KDM4EALDH1A1TOP2A
SCHEMBL13549721 0.85 TOP2A (0.54) TOP2A
SCHEMBL12703960 0.85 TOP2A (0.54) TOP2A
SCHEMBL13268324 0.85 TOP2A (0.54) TOP2A
SCHEMBL5618322 0.84 TOP2A (0.55) TOP2A
SCHEMBL3127235 0.84 TOP2A (0.55) TOP2A
SCHEMBL3067722 0.84 TOP2A (0.51) TOP2A
SCHEMBL13549722 0.84 TOP2A (0.51) TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551849-B1 TRICYCLIC TETRAHYDROQUINOLINE ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2010-07-14 EP claimed
US-7605157-B2 Tricyclic tetrahydroquinoline antibacterial agents PHARMACIA & UPJOHN COMPANY LLC (US) 2009-10-20 US claimed
US-20070161630-A1 Tricyclic tetrahydroquinoline antibacterial agents ZOETIS SERVICES LLC 2007-07-12 US claimed
US-7208490-B2 Tricyclic tetrahydroquinoline antibacterial agents PHARMACIA & UPJOHN COMPANY LLC (US) 2007-04-24 US claimed
US-20040162279-A1 Tricyclic tetrahydroquinoline antibacterial agents ZOETIS SERVICES LLC 2004-08-19 US claimed
US-11858946-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-01-02 US disclosed
US-11858946-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-01-02 US disclosed
US-10995097-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-05-04 US disclosed
US-20190135821-A1 SMALL MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2019-05-09 US disclosed
US-7605157-B2 Tricyclic tetrahydroquinoline antibacterial agents PHARMACIA & UPJOHN COMPANY LLC (US) 2009-10-20 US disclosed
US-20070161630-A1 Tricyclic tetrahydroquinoline antibacterial agents ZOETIS SERVICES LLC 2007-07-12 US disclosed
US-7208490-B2 Tricyclic tetrahydroquinoline antibacterial agents PHARMACIA & UPJOHN COMPANY LLC (US) 2007-04-24 US disclosed
US-20040162279-A1 Tricyclic tetrahydroquinoline antibacterial agents ZOETIS SERVICES LLC 2004-08-19 US 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 (5 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-10995097-B2 Small molecules active against gram-negative bacteria PGLS, MRPL21, CLPP KDM4E 3398/4885ALDH1A1 3613/4885TOP2A 70/4885
US-20070161630-A1 Tricyclic tetrahydroquinoline antibacterial agents QTRT1, QTRT2, NQO2 KDM4E 1604/4885ALDH1A1 1420/4885TOP2A 94/4885
US-20040162279-A1 Tricyclic tetrahydroquinoline antibacterial agents QTRT1, QTRT2, NQO2 KDM4E 1604/4885ALDH1A1 1420/4885TOP2A 94/4885
US-11858946-B2 Small molecules active against gram-negative bacteria PGLS, MRPL21, CLPP KDM4E 3454/4885ALDH1A1 3814/4885TOP2A 99/4885
US-20190135821-A1 SMALL MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA PGLS, MRPL21, CLPP KDM4E 3398/4885ALDH1A1 3613/4885TOP2A 70/4885

“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.