SCHEMBL16407161

SCHEMBL16407161

Cc1cc(NCc2cccc(Nc3ccnc4cc(Cl)ccc34)c2)nc(N2CCOCC2)n1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
PKM P14618 2/20 0.56
APP P05067 4/20 0.50
NR4A2 P43354 1/20 0.50
KDM4E B2RXH2 1/20 0.48
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HPSE Q9Y251 1/20 0.46
RAD52 P43351 1/20 0.45
GFER P55789 1/20 0.45
ACHE P22303 1/20 0.44
DHFR P00374 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL16407345 0.93 APP (0.52) LMNAPKMAPPNR4A2RAD52
SCHEMBL16407352 0.92 APP (0.51) LMNAPKMAPPNR4A2HPSE
SCHEMBL16407072 0.91 RAD52 (0.51) LMNAPKMAPPNR4A2KDM4E
SCHEMBL16407134 0.91 APP (0.54) LMNAPKMAPPNR4A2RAD52
SCHEMBL18500810 0.91 PKM (0.56) LMNAPKMAPPMAPTPOLB
SCHEMBL16407172 0.90 ACHE (0.56) LMNAPKMAPPNR4A2HPSE
SCHEMBL16407051 0.90 APP (0.54) LMNAPKMAPPNR4A2KDM4E
SCHEMBL16407173 0.87 CYP1A2 (0.56) LMNAPKMAPPNR4A2KDM4E
SCHEMBL16407137 0.84 APP (0.59) LMNAPKMAPPNR4A2KDM4E
SCHEMBL15271882 0.84 ALDH1A1 (0.56) LMNAPKMDHFRALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220008418-A1 Aminoquinoline Derivatives and Uses Thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-01-13 US disclosed
US-11026943-B2 Aminoquinoline derivatives and uses thereof THE MCLEAN HOSPITAL CORPORATION (US) 2021-06-08 US disclosed
US-20170209441-A1 AMINOQUINOLINE DERIVATIVES AND USES THEREOF UNIVERSITY OF DELHI (IN) 2017-07-27 US disclosed
US-9567316-B2 Aminoquinoline derivatives and uses thereof THE MCLEAN HOSPITAL CORPORATION (US) 2017-02-14 US disclosed
US-20150023930-A1 AMINOQUINOLINE DERIVATIVES AND USES THEREOF THE MCLEAN HOSPITAL CORPORATION (US) 2015-01-22 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 (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-20150023930-A1 AMINOQUINOLINE DERIVATIVES AND USES THEREOF LRRK2, NLN, AADAT LMNA 1364/4885PKM 2102/4885APP 219/4885
US-20220008418-A1 Aminoquinoline Derivatives and Uses Thereof LRRK2, NLN, AADAT LMNA 1364/4885PKM 2102/4885APP 219/4885
US-11026943-B2 Aminoquinoline derivatives and uses thereof LRRK2, NLRP3, AADAT LMNA 1443/4885PKM 2112/4885APP 256/4885
US-20170209441-A1 AMINOQUINOLINE DERIVATIVES AND USES THEREOF LRRK2, NLRP3, AADAT LMNA 1443/4885PKM 2112/4885APP 256/4885

“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.