SCHEMBL340989

SCHEMBL340989

O=c1cc(-c2ccccc2OCc2ccccc2)[nH]c2ccc(N3CCOCC3)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.56
PRKDC P78527 5/20 0.55
ATM Q13315 1/20 0.52
KIF11 P52732 3/20 0.50
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49
P2RY12 Q9H244 1/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
HPGD P15428 3/20 0.43
CASP1 P29466 2/20 0.43
CASP7 P55210 2/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
PIK3C3 Q8NEB9 1/20 0.43
CYP3A4 P08684 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
SCHEMBL339658 0.91 TUBB4A (0.52) PIK3CGPRKDCATMKIF11KDM4E
SCHEMBL339150 0.85 IMPDH2 (0.54) PRKDCKIF11KDM4EALDH1A1MEN1
SCHEMBL340812 0.85 PRMT5 (0.58) PIK3CGPRKDCKIF11KDM4EALDH1A1
SCHEMBL341203 0.84 TUBB4A (0.52) PIK3CGKIF11KDM4EALDH1A1MEN1
SCHEMBL340707 0.83 TUBB4A (0.60) PIK3CGPRKDCATMKIF11KDM4E
SCHEMBL26685280 0.80 CTSV (0.54) PIK3CGPRKDCKDM4EALDH1A1MEN1
SCHEMBL339602 0.79 KIF11 (0.50) PIK3CGPRKDCKIF11KDM4EALDH1A1
SCHEMBL339316 0.78 TUBB4A (0.53) PRKDCKIF11KDM4EALDH1A1MEN1
SCHEMBL341333 0.76 SRD5A2 (0.44) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL340263 0.75 TUBB4A (0.59) KIF11KDM4EALDH1A1HPGDLMNA

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 PIK3CG 2861/4885PRKDC 4128/4885ATM 3918/4885

“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.