SCHEMBL5401757

SCHEMBL5401757

CCc1nc(OC)c(N)cc1C(=O)NC(C)C(=O)Nc1cc(CO)cc(Nc2c3ccccc3nc3c(C)c(C)ccc23)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 9/20 0.40
TOP2B Q02880 8/20 0.40
CTSD P07339 2/20 0.38
KDM1A O60341 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PTGER4 P35408 1/20 0.33
MAPT P10636 1/20 0.32
CYP3A4 P08684 1/20 0.32
PARP1 P09874 1/20 0.32
CYP2C9 P11712 1/20 0.32
TP53 P04637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL5401753 0.93 TOP2A (0.40) TOP2ATOP2BCTSDKDM1AMEN1
SCHEMBL5398724 0.92 TOP2A (0.47) TOP2ATOP2BKDM1AKMT2AMAPT
SCHEMBL5405660 0.91 TOP2A (0.41) TOP2ATOP2BKDM1APARP1TP53
SCHEMBL5401696 0.89 TOP2A (0.43) TOP2ATOP2BKDM1APARP1
SCHEMBL5404239 0.86 TOP2A (0.46) TOP2ATOP2BKDM1AKMT2AMAPT
SCHEMBL5394372 0.85 TOP2A (0.49) TOP2ATOP2BKDM1AMEN1KMT2A
SCHEMBL5398721 0.84 TOP2A (0.47) TOP2ATOP2BKDM1AKMT2AMAPT
SCHEMBL5405656 0.83 PARP1 (0.44) TOP2ATOP2BKDM1ACYP3A4PARP1
SCHEMBL5401693 0.82 TOP2A (0.43) TOP2ATOP2BPARP1
SCHEMBL6159102 0.80 TOP2A (0.46) TOP2ATOP2BCTSDKDM1AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230105-B2 9-aminoacridine derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2007-06-12 US disclosed
US-20050222167-A1 9-aminoacridine derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2005-10-06 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-20050222167-A1 9-aminoacridine derivatives and process for the preparation thereof PARP9, CASP9, AMPD2 TOP2A 131/4885TOP2B 209/4885CTSD 1587/4885

“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.