SCHEMBL3218896

SCHEMBL3218896

CCOC(=O)c1cccc(-c2nccc3cc(CBr)oc23)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
SYK P43405 1/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
JMJD6 Q6NYC1 2/20 0.43
KDM4E B2RXH2 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
SCHEMBL1849694 0.91 HPGD (0.46) TP53POLBHPGDSYKNPC1
SCHEMBL1862448 0.82 GPR52 (0.51) TP53POLBHPGDSYKNPC1
SCHEMBL16237821 0.74 TP53 (0.49) TP53POLBHPGDSYKNPC1
SCHEMBL16237057 0.72 SYK (0.48) TP53POLBHPGDSYKNPC1
SCHEMBL1849947 0.72 HPGD (0.46) TP53POLBHPGDSYKNPC1
SCHEMBL1847641 0.71 JMJD6 (0.47) TP53POLBHPGDSYKNPC1
SCHEMBL29617015 0.71 TP53 (0.62) TP53POLBHPGDNPC1RAB9A
SCHEMBL16237588 0.70 TYK2 (0.46) TP53POLBHPGDSYKNPC1
SCHEMBL1854408 0.69 HPGD (0.46) TP53POLBHPGDNPC1RAB9A
SCHEMBL4193217 0.69 TP53 (0.61) TP53POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 TP53 3403/4885POLB 4067/4885HPGD 2979/4885

“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.