SCHEMBL340813

SCHEMBL340813

O=C1CC(c2ccc(OCc3ccccc3)cc2)=Nc2ccc(N3CCOCC3)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 6/20 0.52
PRMT5 O14744 3/20 0.46
MCHR1 Q99705 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 2/20 0.44
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GSTP1 P09211 1/20 0.43
EGFR P00533 1/20 0.42
DGAT1 O75907 1/20 0.42
ALKBH1 Q13686 1/20 0.42

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
SCHEMBL340264 0.91 GSTP1 (0.45) PRKDCPRMT5MCHR1GSTP1EGFR
SCHEMBL340708 0.91 PRKDC (0.54) PRKDCMCHR1MRGPRX4ALDH1A1MEN1
SCHEMBL341204 0.86 MAPT (0.45) PRKDCALDH1A1KDM4EHPGDTSHR
SCHEMBL340990 0.85 CNR1 (0.53) PRKDCALDH1A1TSHRHSD17B10MEN1
SCHEMBL339016 0.84 PRKDC (0.50) PRKDCALDH1A1HSD17B10MEN1KMT2A
SCHEMBL341305 0.82 KIF11 (0.46) PRKDCMAPTALK
SCHEMBL339561 0.82 PRKDC (0.43) PRKDCMCHR1KMT2AATMMAPT
SCHEMBL340508 0.78 FYN (0.48) PRKDCALDH1A1NPC1MAPTRAB9A
SCHEMBL28211954 0.77 KMT2A (0.62) PRKDCPRMT5MCHR1MRGPRX4ALDH1A1
SCHEMBL339925 0.77 GSTP1 (0.47) PRMT5ALDH1A1KDM4EHPGDHSD17B10

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 6 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
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 PRKDC 4128/4885PRMT5 4380/4885MCHR1 2424/4885

“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.