SCHEMBL1850600

SCHEMBL1850600

CCOC(=O)c1cccc(-c2ccc(Cl)c3cc(CO)sc23)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 2/20 0.43
CYP1A2 P05177 1/20 0.43
PRKDC P78527 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GALR1 P47211 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
PRF1 P14222 1/20 0.40

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
SCHEMBL1854211 0.95 TP53 (0.41) TP53POLBHPGDRAB9ACYP1A2
SCHEMBL1854682 0.90 TP53 (0.43) TP53POLBHPGDRAB9ACYP1A2
SCHEMBL1850410 0.87 GPR52 (0.47) TP53POLBHPGDRAB9APRKDC
SCHEMBL3217605 0.83 GPR52 (0.47) TP53POLBHPGDRAB9ACYP1A2
SCHEMBL1848922 0.83 GPR52 (0.46) TP53POLBHPGDPRKDCCYP4F2
SCHEMBL1851960 0.83 GPR52 (0.55) TP53POLBHPGDRAB9ACYP1A2
SCHEMBL1851317 0.83 GPR52 (0.43) TP53POLBHPGDRAB9APRKDC
SCHEMBL1851227 0.81 GPR52 (0.44) TP53POLBHPGDRAB9ACYP1A2
SCHEMBL1851748 0.80 GPR52 (0.44) TP53POLBHPGDRAB9ACYP1A2
SCHEMBL1867001 0.80 GPR52 (0.53) TP53POLBHPGDRAB9ACYP1A2

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
EP-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
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.