SCHEMBL340956

SCHEMBL340956

CC(=O)c1cc(N(C)C)ccc1NC(=O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.62
MEN1 O00255 2/20 0.62
NR1H4 Q96RI1 4/20 0.58
MAOB P27338 1/20 0.58
SMPD1 P17405 1/20 0.56
HDAC1 Q13547 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
ALDH1A1 P00352 3/20 0.54
TSHR P16473 2/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 3/20 0.52
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
USP2 O75604 1/20 0.52
MAPK1 P28482 1/20 0.52
ESR2 Q92731 1/20 0.52
TAAR1 Q96RJ0 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
SCHEMBL339377 0.89 NPC1 (0.57) KMT2AMEN1NR1H4MAOBALDH1A1
SCHEMBL339705 0.82 MEN1 (0.60) KMT2AMEN1ALDH1A1GAATDP1
SCHEMBL339004 0.80 MAPT (0.66) KMT2AMEN1NR1H4MAOBSMPD1
SCHEMBL7710629 0.78 KDM4E (0.66) KMT2AMEN1NR1H4MAOBSMPD1
SCHEMBL6358261 0.78 ALDH1A1 (0.66) KMT2AMEN1NR1H4MAOBSMPD1
SCHEMBL340905 0.78 ALDH1A1 (0.66) KMT2AMEN1NR1H4ALDH1A1TSHR
SCHEMBL15233688 0.78 RAB9A (0.64) KMT2AMEN1NR1H4MAOBSMPD1
SCHEMBL7713160 0.77 SMPD1 (0.64) KMT2AMEN1NR1H4MAOBSMPD1
SCHEMBL22213598 0.76 NR1H4 (0.63) KMT2AMEN1NR1H4SMPD1HDAC1
SCHEMBL6352019 0.76 AKR1C2 (0.78) KMT2AMEN1NR1H4SMPD1HDAC1

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 4 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
US-8524740-B2 Synthesis and anticancer activity of aryl and heteroaryl-quinolin derivatives TAIRX, INC. (TW) 2013-09-03 US disclosed
US-20120015908-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Efficient Pharma Management Corporate (TW) 2012-01-19 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 (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 KMT2A 2015/4885MEN1 2493/4885NR1H4 879/4885

“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.