SCHEMBL5152018

SCHEMBL5152018

Cc1cc(OC(F)(F)F)cc(C(=O)Nc2cccc(OC3CCN(C(=O)c4ccno4)CC3)c2)c1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 4/20 0.44
CSF1R P07333 1/20 0.40
PDGFRB P09619 1/20 0.40
KIT P10721 1/20 0.40
DDR1 Q08345 1/20 0.40
SCD5 Q86SK9 1/20 0.40
SCN9A Q15858 1/20 0.39
TRPV4 Q9HBA0 1/20 0.37
FLT1 P17948 1/20 0.37
BRAF P15056 1/20 0.37
KDR P35968 1/20 0.37
RXFP2 Q8WXD0 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
NR1H4 Q96RI1 1/20 0.36
PGR P06401 1/20 0.36
GPR183 P32249 1/20 0.36
SMO Q99835 1/20 0.36

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
SCHEMBL3288508 0.89 PRKAA2 (0.44) PRKAA2CSF1RPDGFRBKITDDR1
SCHEMBL5143997 0.86 EPHX2 (0.48) PRKAA2CSF1RPDGFRBKITDDR1
SCHEMBL5144228 0.86 EPHX2 (0.45)
SCHEMBL5298159 0.84 MAPT (0.44) PRKAA2RXFP1
SCHEMBL5143816 0.84 PRKAA2 (0.41) PRKAA2SCN9A
SCHEMBL5145627 0.84 EPHX2 (0.43) PRKAA2
SCHEMBL5142098 0.84 KMT2A (0.45) PRKAA2
SCHEMBL3289150 0.84 SMO (0.44) PRKAA2SCD5RXFP2RXFP1PGR
SCHEMBL3317661 0.84 L3MBTL1 (0.44) PRKAA2CSF1RPDGFRBKITDDR1
SCHEMBL3290058 0.83 CFD (0.42) RXFP1NR1H4

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-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems MERCK PATENT GMBH (DE) 2007-11-01 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-20070254919-A1 Aroyl-O-Piperidine Derivatives for the Treatment of Diabetes-Related Problems GPR119, FABP4, LIPC PRKAA2 2191/4885CSF1R 1152/4885PDGFRB 1008/4885

“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.