SCHEMBL4294947

SCHEMBL4294947

O=C(c1cccc(N2CCCNCC2)n1)N1CCC(Oc2ccccc2F)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.44
PRKCQ Q04759 2/20 0.44
PRKCD Q05655 2/20 0.44
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HRH3 Q9Y5N1 2/20 0.38
KDM5A P29375 1/20 0.37
RBP4 P02753 1/20 0.37
HTR2C P28335 1/20 0.37
HSD11B1 P28845 1/20 0.37
HSD17B14 Q9BPX1 1/20 0.37
MCHR1 Q99705 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
HTR1A P08908 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TTR P02766 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
SCHEMBL4293266 1.00 PRKCA (0.44) PRKCAPRKCQPRKCDKMT2AUSP2
SCHEMBL4297766 1.00 PRKCA (0.44) PRKCAPRKCQPRKCDKMT2AUSP2
Hydrochloric Acid SCHEMBL4290938 0.99 PRKCA (0.43) PRKCAPRKCQPRKCDKMT2AUSP2
Hydrochloric Acid SCHEMBL4290942 0.99 PRKCA (0.43) PRKCAPRKCQPRKCDKMT2AUSP2
SCHEMBL4299614 0.96 PRKCA (0.43) PRKCAPRKCQPRKCDKMT2AUSP2
SCHEMBL4299135 0.96 PRKCA (0.43) PRKCAPRKCQPRKCDKMT2AUSP2
SCHEMBL4299133 0.96 PRKCA (0.43) PRKCAPRKCQPRKCDKMT2AUSP2
SCHEMBL3470317 0.89 PRKCA (0.44) PRKCAPRKCQPRKCDKMT2AHRH3
SCHEMBL3470315 0.89 PRKCA (0.44) PRKCAPRKCQPRKCDKMT2AHRH3
SCHEMBL4292996 0.89 PRKCA (0.44) PRKCAPRKCQPRKCDKMT2AHRH3

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-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 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-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders HTR6, HTR5A, TPH1 PRKCA 3735/4885PRKCQ 2560/4885PRKCD 3188/4885

“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.