SCHEMBL3218977

SCHEMBL3218977

O=C(O)c1ccc(Cl)c(-c2ccc(-c3ccccn3)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
KDM6B O15054 1/20 0.54
KDM4A O75164 1/20 0.54
KDM5C P41229 1/20 0.54
KDM4C Q9H3R0 1/20 0.54
KDM2A Q9Y2K7 1/20 0.54
KDM3A Q9Y4C1 1/20 0.54
KMO O15229 1/20 0.52
TGFBR1 P36897 1/20 0.49
CHEK2 O96017 1/20 0.48
DHODH Q02127 2/20 0.48
LDHA P00338 1/20 0.45
MAP4K4 O95819 1/20 0.45
S1PR1 P21453 1/20 0.45
S1PR3 Q99500 1/20 0.45
MARS1 P56192 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
SCHEMBL13117407 0.88 KDM4C (0.59) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL3208897 0.83 KDM4C (0.54) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL3205630 0.82 TSHR (0.55) KMOMAP4K4
SCHEMBL3200062 0.82 TSHR (0.59) KMO
SCHEMBL29788328 0.82 KDM4E (0.61) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL5858 0.82 KDM4E (0.61) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL29306758 0.81 NPC1 (0.46) KDM4ETGFBR1CHEK2
Hydrochloric Acid SCHEMBL3066744 0.80 KDM4E (0.59) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL28399239 0.80 KDM4E (0.59) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL3208905 0.80 KDM4C (0.50) KDM4EKDM6BKDM4AKDM5CKDM4C

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 987/4885KDM6B 802/4885KDM4A 864/4885

“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.