SCHEMBL5202131

SCHEMBL5202131

Cc1ccc(F)c([C]=O)c1Cl

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.31
ADRA2A P08913 1/20 0.30
CLCN2 P51788 1/20 0.30
CYP3A4 P08684 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL4697050 0.79 ALDH1A1 (0.36) CYP3A4
SCHEMBL1197431 0.78 ACHE (0.32) CYP3A4ACHE
SCHEMBL909850 0.78 LMNA (0.38) CLCN2CYP3A4
SCHEMBL7703149 0.74 CES2 (0.31)
SCHEMBL2578269 0.72 ACHE (0.38) P2RX7ADRA2ACLCN2CYP3A4ACHE
SCHEMBL28566856 0.71 GABRA1 (0.40) CYP3A4
SCHEMBL10595967 0.70 ACHE (0.36) P2RX7ADRA2ACLCN2CYP3A4ACHE
SCHEMBL8249627 0.70 ACHE (0.36) P2RX7ADRA2ACLCN2CYP3A4ACHE
SCHEMBL9712454 0.70 SLC2A1 (0.35)
SCHEMBL21201458 0.70 TNF (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 US disclosed
EP-1654253-B1 SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES GRUENENTHAL GMBH (DE) 2007-01-03 EP 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-20130231327-A1 Substituted Spiro-Amide Compounds BDKRB1, BDKRB2, REN P2RX7 314/4885ADRA2A 201/4885CLCN2 2412/4885

“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.