SCHEMBL5732275

SCHEMBL5732275

O=C1CCN(Cc2cnn(-c3ccc(-c4ccccc4)cc3)c2-c2ccccc2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.45
DHODH Q02127 3/20 0.40
TACR1 P25103 3/20 0.39
SMO Q99835 2/20 0.39
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ACHE P22303 1/20 0.37
ROCK2 O75116 2/20 0.37
HIF1A Q16665 1/20 0.36
USP7 Q93009 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HTR7 P34969 1/20 0.35
NR3C1 P04150 1/20 0.35

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
SCHEMBL5227102 0.87 LMNA (0.44) SSTR5SMODRD2DRD4DRD3
SCHEMBL5907390 0.86 SSTR5 (0.42) SSTR5DHODHSMODRD2DRD4
SCHEMBL7257441 0.86 SSTR5 (0.42) SSTR5DHODHSMODRD2DRD4
SCHEMBL1689504 0.86 SMO (0.45) SSTR5SMODRD2DRD4DRD3
SCHEMBL7262116 0.86 SMO (0.45) SSTR5SMODRD2DRD4DRD3
SCHEMBL7260439 0.85 SSTR5 (0.46) SSTR5SMODRD2DRD4DRD3
SCHEMBL7256641 0.84 SSTR5 (0.40) SSTR5DHODHSMODRD2DRD4
SCHEMBL7256580 0.84 SSTR5 (0.42) SSTR5DHODHSMODRD2DRD4
SCHEMBL7256608 0.84 SSTR5 (0.42) SSTR5SMODRD2DRD4DRD3
SCHEMBL7261185 0.84 SMO (0.39) SSTR5SMODRD2DRD4DRD3

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-20060264419-A1 Substituted pyrazoles MERCK PATENT GMBH (DE) 2006-11-23 US disclosed
EP-1626967-A1 SUBSTITUTED PYRAZOLES MERCK PATENT GmbH (DE) 2006-02-22 EP disclosed
WO-2004089931-A1 SUBSTITUTED PYRAZOLES MERCK PATENT GMBH (DE) 2004-10-21 WO 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-20060264419-A1 Substituted pyrazoles HTR3A, HTR1A, HTR1D SSTR5 97/4885DHODH 3663/4885TACR1 100/4885

“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.