SCHEMBL1534473

SCHEMBL1534473

O=c1c(I)c(-c2ccccc2)oc2nc(Cl)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 3/20 0.43
CYP1A2 P05177 3/20 0.43
TSHR P16473 3/20 0.43
CYP2C19 P33261 3/20 0.43
LMNA P02545 2/20 0.43
PKM P14618 2/20 0.43
ADORA1 P30542 2/20 0.43
GMNN O75496 1/20 0.43
ADORA2A P29274 1/20 0.43
MTOR P42345 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
HIF1A Q16665 1/20 0.43
ADORA3 P0DMS8 2/20 0.41
ABCG2 Q9UNQ0 5/20 0.40
ABCC1 P33527 2/20 0.37
CYP3A4 P08684 4/20 0.35
CYP1B1 Q16678 3/20 0.35
MEN1 O00255 2/20 0.35

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
SCHEMBL1534422 0.81 ADORA2A (0.45) KDM4EHSD17B10CYP1A2TSHRCYP2C19
SCHEMBL1534584 0.78 KDM4E (0.54) KDM4EHSD17B10CYP1A2LMNAPKM
SCHEMBL1534689 0.72 ADORA3 (0.40) KDM4EHSD17B10CYP1A2TSHRCYP2C19
SCHEMBL1423181 0.71 KMT2A (0.65) KDM4EHSD17B10TSHRCYP2C19LMNA
SCHEMBL1534784 0.71 AKT1 (0.47)
SCHEMBL1534406 0.70 ABCG2 (0.38) KDM4EHSD17B10CYP1A2TSHRCYP2C19
SCHEMBL22171892 0.70 KDM4E (0.60) KDM4EHSD17B10LMNAADORA3CYP3A4
Hydrochloric Acid SCHEMBL1534515 0.70 AKT1 (0.46)
SCHEMBL1534783 0.70 ABCG2 (0.38) KDM4EHSD17B10CYP1A2TSHRCYP2C19
SCHEMBL1534723 0.69 PDE3B (0.37) KDM4EHSD17B10TSHRCYP2C19LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546376-B2 Pharmaceutical compounds ALMAC DISCOVERY LIMITED (GB) 2013-10-01 US disclosed
US-20120238541-A1 PHARMACEUTICAL COMPOUNDS ALMAC DISCOVERY LIMITED (GB) 2012-09-20 US disclosed
EP-2473495-A1 PHARMACEUTICAL COMPOUNDS Almac Discovery Limited (GB) 2012-07-11 EP disclosed
WO-2011033265-A1 PHARMACEUTICAL COMPOUNDS ALMAC DISCOVERY LIMITED (GB) 2011-03-24 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-20120238541-A1 PHARMACEUTICAL COMPOUNDS PIK3CA, PLK1, MTOR KDM4E 1952/4885HSD17B10 2447/4885CYP1A2 4256/4885

“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.