SCHEMBL3293187

SCHEMBL3293187

CN(CCCNC(=O)c1c2ccccc2nc2ccccc12)CCCNC(=O)c1c2ccccc2nc2c1[nH]c1ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 4/20 0.55
OPRM1 P35372 1/20 0.48
OPRK1 P41145 1/20 0.48
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
MEN1 O00255 1/20 0.47
MITF O75030 1/20 0.47
POLB P06746 1/20 0.47
RAD52 P43351 1/20 0.47
KMT2A Q03164 1/20 0.47
ACKR3 P25106 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TP53 P04637 2/20 0.44
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL13520610 0.98 TERT (0.57) TERTOPRM1OPRK1TMEM97SIGMAR1
SCHEMBL3520767 0.88 TERT (0.64) TERTMEN1MITFPOLBRAD52
SCHEMBL3517478 0.88 TERT (0.49) TERTOPRM1OPRK1TMEM97SIGMAR1
SCHEMBL3293980 0.87 TERT (0.49) TERTKDM4EHDAC3HDAC4HDAC1
SCHEMBL3292099 0.87 TP53 (0.61) TERTMEN1POLBKMT2AKDM4E
SCHEMBL3290737 0.84 BCHE (0.46) TERTMEN1POLBKMT2ATP53
SCHEMBL3520973 0.80 TERT (0.47) TERTMEN1POLBKMT2AKDM4E
SCHEMBL13338303 0.80 MEN1 (0.49) TERTMEN1POLBKMT2AKDM4E
SCHEMBL3518638 0.79 TERT (0.47) TERTMEN1POLBKMT2AKDM4E
SCHEMBL29196428 0.78 TERT (0.54) TERTMEN1POLBKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100331355-A1 Substituted Quinolines for the Treatment of Cancer CRYSTAX PHARMACEUTICALS, S.L. (ES) 2010-12-30 US claimed
US-7728000-B2 Substituted quinolines for the treatment of cancer CRYSTAX PHARMACEUTICALS (ES) 2010-06-01 US claimed
JP-2007511573-A 2007-05-10 JP claimed
US-20070105784-A1 Substituted quinolines for the treatment of cancer CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2007-05-10 US claimed
EP-1687304-A1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF CANCER Crystax Pharmaceuticals S.L. (ES) 2006-08-09 EP claimed
WO-2005054236-A1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF CANCER CRYSTAX PHARMACEUTICALS S.L. (ES) 2005-06-16 WO claimed
US-20100331355-A1 Substituted Quinolines for the Treatment of Cancer CRYSTAX PHARMACEUTICALS, S.L. (ES) 2010-12-30 US disclosed
US-7728000-B2 Substituted quinolines for the treatment of cancer CRYSTAX PHARMACEUTICALS (ES) 2010-06-01 US disclosed
US-20070105784-A1 Substituted quinolines for the treatment of cancer CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2007-05-10 US disclosed
EP-1687304-A1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF CANCER Crystax Pharmaceuticals S.L. (ES) 2006-08-09 EP disclosed
WO-2005054236-A1 SUBSTITUTED QUINOLINES FOR THE TREATMENT OF CANCER CRYSTAX PHARMACEUTICALS S.L. (ES) 2005-06-16 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 (2 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-20070105784-A1 Substituted quinolines for the treatment of cancer TOP2B, NQO2, SNRPD2 TERT 1359/4885OPRM1 1978/4885OPRK1 1398/4885
US-20100331355-A1 Substituted Quinolines for the Treatment of Cancer TOP2B, TOP1, TOP2A TERT 1447/4885OPRM1 2039/4885OPRK1 1696/4885

“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.