SCHEMBL902603

SCHEMBL902603

COc1cccc(Sc2c3ccccc3nc3cccc(Br)c23)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 5/20 0.57
EDNRA P25101 3/20 0.48
DHFR P00374 2/20 0.48
CYP1A2 P05177 3/20 0.44
CYP3A4 P08684 3/20 0.44
CYP2C9 P11712 3/20 0.44
CYP2B6 P20813 2/20 0.44
AHR P35869 2/20 0.44
NR1I3 Q14994 2/20 0.44
CYP2D6 P10635 2/20 0.44
VDR P11473 1/20 0.44
MAPK1 P28482 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
EDNRB P24530 1/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP2C19 P33261 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL902232 0.88 KDM1A (0.47) ABCG2DHFRCYP1A2LMNAMAPT
SCHEMBL15397407 0.87 ABCG2 (0.67) ABCG2EDNRADHFRCYP1A2CYP3A4
SCHEMBL902453 0.83 DHFR (0.44) ABCG2DHFRCYP1A2CYP3A4CYP2C9
SCHEMBL902614 0.79 DYRK1A (0.43) ABCG2EDNRADHFRLMNAKDM4E
SCHEMBL15397420 0.78 KDM1A (0.50) ABCG2DHFRCYP1A2LMNAMAPT
SCHEMBL901828 0.76 KDM1A (0.50) ABCG2DHFRCYP1A2MAPK1LMNA
SCHEMBL901721 0.75 TOP2A (0.47) ABCG2MAPTKDM4ETSHRHTT
SCHEMBL18252667 0.74 EDNRA (0.49) ABCG2EDNRADHFRCYP3A4EDNRB
SCHEMBL902724 0.73 SMN1; SMN2 (0.45) ABCG2CYP2C9CYP2D6LMNAMAPT
SCHEMBL15397415 0.71 DHFR (0.41) DHFRCYP1A2NR1I3MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130310411-A1 NOVEL ACRIDINE DERIVATIVES PHARMINOX LIMITED (GB) 2013-11-21 US disclosed
US-20130310411-A1 NOVEL ACRIDINE DERIVATIVES PHARMINOX LIMITED (GB) 2013-11-21 US disclosed
EP-2621929-A1 NOVEL ACRIDINE DERIVATIVES Pharminox Limited (GB) 2013-08-07 EP disclosed
WO-2012042265-A1 NOVEL ACRIDINE DERIVATIVES PHARMINOX LIMITED (GB) 2012-04-05 WO disclosed
WO-2012042265-A1 NOVEL ACRIDINE DERIVATIVES PHARMINOX LIMITED (GB) 2012-04-05 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-20130310411-A1 NOVEL ACRIDINE DERIVATIVES TERT, NAT10, POT1 ABCG2 3413/4885EDNRA 3512/4885DHFR 723/4885

“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.