SCHEMBL3207980

SCHEMBL3207980

O=C(O)c1cccc(-c2ccc(-c3ccccc3)cc2)n1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.59
ALOX15 P16050 1/20 0.59
TSHR P16473 1/20 0.59
ACMSD Q8TDX5 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
MCL1 Q07820 3/20 0.57
MEN1 O00255 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
KAT6A Q92794 1/20 0.51
FAAH O00519 1/20 0.51
HSD17B14 Q9BPX1 1/20 0.50
ERN1 O75460 1/20 0.50
ECE1 P42892 1/20 0.50
KMO O15229 2/20 0.49
CNR2 P34972 1/20 0.48
CTRC Q99895 1/20 0.47
DHODH Q02127 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL208097 0.96 KDM4E (0.64) KDM4EALOX15TSHRACMSDTDP1
Hydrochloric Acid SCHEMBL29133274 0.94 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
Dipicolinic Acid SCHEMBL23071472 0.86 KDM4E (0.81) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL30367705 0.85 HSD17B14 (0.57) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL30614607 0.85 SMN1; SMN2 (0.56) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL3054637 0.85 CNR2 (0.56) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL1137226 0.85 HSD17B14 (0.57) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL244468 0.85 SMN1; SMN2 (0.56) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL31301301 0.85 CNR2 (0.56) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL3129022 0.84 MCL1 (0.67) KDM4EALOX15TSHRACMSDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 US disclosed
WO-2006022955-A2 TOPOISOMERASE INHIBITORS PROPHARMACON, INC. (US) 2006-03-02 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-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B KDM4E 987/4885ALOX15 3427/4885TSHR 4456/4885

“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.