SCHEMBL5886308

SCHEMBL5886308

COC(=O)c1cccc2c1ccc1nc3cccc(C(=O)O)c3nc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 6/20 0.49
KMT2A Q03164 5/20 0.49
GAA P10253 1/20 0.49
ATM Q13315 1/20 0.49
MEN1 O00255 4/20 0.43
TSHR P16473 1/20 0.43
PSMD14 O00487 1/20 0.41
SLC40A1 Q9NP59 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PLIN1 O60240 1/20 0.39
LMNA P02545 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL5886271 0.84 ALDH1A1 (0.54) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL5886496 0.83 ALDH1A1 (0.52) ALDH1A1KDM4EKMT2AGAAMEN1
SCHEMBL5886260 0.83 KMT2A (0.51) ALDH1A1KDM4EKMT2AGAAATM
SCHEMBL30149921 0.83 KMT2A (0.67) ALDH1A1KDM4EKMT2AGAAATM
SCHEMBL3725674 0.83 KMT2A (0.67) ALDH1A1KDM4EKMT2AGAAATM
SCHEMBL5886249 0.82 ALDH1A1 (0.58) ALDH1A1KDM4EGAAMAPTLMNA
SCHEMBL5886447 0.81 KMT2A (0.54) ALDH1A1KDM4EKMT2AGAAATM
SCHEMBL5886270 0.81 GAA (0.52) ALDH1A1KDM4EKMT2AGAAATM
SCHEMBL5886240 0.81 ALDH1A1 (0.59) ALDH1A1KDM4EKMT2AGAAMEN1
SCHEMBL5886245 0.81 KDM4E (0.41) ALDH1A1KDM4EKMT2AGAAATM

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-7132419-B2 Pharmaceutical compounds XENOVA LIMITED (GB) 2006-11-07 US disclosed
US-20050143383-A1 Pharmaceutical compounds XENOVA LIMITED (GB) 2005-06-30 US disclosed
US-20030139409-A1 Benzo[A] [phenazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II XENOVA LIMITED (GB) 2003-07-24 US disclosed
EP-1240148-A1 BENZO[A]PHENAZIN-11-CARBOXAMIDE DERIVATIVES AND THEIR USE AS JOINT INHIBITORS OF TOPOMERASE I AND II Xenova Limited (GB) 2002-09-18 EP disclosed
WO-2001046157-A1 BENZO[A]PHENAZIN-11-CARBOXAMIDE DERIVATIVES AND THEIR USE AS JOINT INHIBITORS OF TOPOMERASE I AND II XENOVA LIMITED (GB) 2001-06-28 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-20050143383-A1 Pharmaceutical compounds CHRNA10, OPRM1, SCN10A ALDH1A1 3766/4885KDM4E 3704/4885KMT2A 3473/4885
US-20030139409-A1 Benzo[A] [phenazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II TOP1, TOP2A, TOP2B ALDH1A1 2334/4885KDM4E 1785/4885KMT2A 2184/4885

“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.