SCHEMBL4290478

SCHEMBL4290478

CN1CCN(c2cccc(C(=O)N3CCC(Cc4ccccc4F)CC3)n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B14 Q9BPX1 1/20 0.48
USP2 O75604 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK14 Q16539 1/20 0.43
NLN Q9BYT8 2/20 0.42
DRD2 P14416 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
GRIN2B Q13224 1/20 0.41
KMT2A Q03164 1/20 0.40
F2 P00734 1/20 0.40
PRKCQ Q04759 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
MGLL Q99685 1/20 0.39
HTR6 P50406 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
SCHEMBL3467150 0.82 HSD17B14 (0.50) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL3469979 0.82 USP2 (0.52) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL3466177 0.80 HSD17B14 (0.49) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL3466779 0.80 HSD17B14 (0.49) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL4304173 0.79 HSD17B14 (0.47) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL3467772 0.79 HSD17B14 (0.48) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL4297856 0.79 HSD17B14 (0.48) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL3466475 0.78 HSD17B14 (0.49) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL4301974 0.77 HSD17B14 (0.51) HSD17B14USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL4305205 0.77 HSD17B14 (0.51) HSD17B14USP2MAPK1SMN1; SMN2PRKCQ

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
US-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 US disclosed
US-20090197859-A1 Pyridinyl Amides for the Treatment of CNS and Metabolic Disorders PFIZER INC. 2009-08-06 US disclosed
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 HSD17B14 2214/4885USP2 4670/4885MAPK1 1674/4885

“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.