SCHEMBL341625

SCHEMBL341625

COc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2C(C)=O)ccc1OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
MAPT P10636 4/20 0.60
ALDH1A1 P00352 4/20 0.60
PKM P14618 1/20 0.60
KDM4E B2RXH2 4/20 0.58
CYP3A4 P08684 1/20 0.57
LRRK2 Q5S007 1/20 0.57
SLCO1B1 Q9Y6L6 1/20 0.57
HTT P42858 2/20 0.57
MAPK14 Q16539 1/20 0.55
BRD4 O60885 2/20 0.50
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 1/20 0.49
USP2 O75604 1/20 0.49
RAB9A P51151 1/20 0.49
HPGD P15428 2/20 0.49
APP P05067 1/20 0.49

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
SCHEMBL341059 0.92 MEN1 (0.61) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL341357 0.87 KMT2A (0.69) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL340260 0.86 LRRK2 (0.65) MEN1KMT2AMAPTCYP3A4LRRK2
SCHEMBL340905 0.85 ALDH1A1 (0.66) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL339593 0.80 BRPF1 (0.60) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL4295800 0.80 MAPT (0.61) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL1318286 0.78 LRRK2 (0.64) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL341381 0.78 MAPT (0.63) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL340278 0.77 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1PKM
SCHEMBL339293 0.77 LRRK2 (0.63) MEN1KMT2AMAPTCYP3A4LRRK2

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
EP-3112348-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Tairx, Inc. (TW) 2017-01-04 EP disclosed
EP-2593435-B1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES TAIRX INC (TW) 2016-09-07 EP disclosed
CN-103347859-B Synthesis and Anticancer Activity of Aryl and Heteroaryl Quinoline Derivatives EFFICIENT PHARMA MANAGEMENT CORP. (CN) 2015-12-02 CN disclosed
CN-103347859-A Synthesis and Anticancer Activity of Aryl and Heteroaryl Quinoline Derivatives EFFICIENT PHARMA MAN CORP 2013-10-09 CN disclosed
US-8524740-B2 Synthesis and anticancer activity of aryl and heteroaryl-quinolin derivatives TAIRX, INC. (TW) 2013-09-03 US disclosed
EP-2593435-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Tairx, Inc. (TW) 2013-05-22 EP disclosed
US-20120015908-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Efficient Pharma Management Corporate (TW) 2012-01-19 US disclosed
WO-2012009519-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES EFFICIENT PHARMA MANAGEMENT CORP. (TW) 2012-01-19 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 (1 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-20120015908-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES SLC22A8, ABCC8, CYP2C8 MEN1 2493/4885KMT2A 2015/4885MAPT 4760/4885

“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.