SCHEMBL4472198

SCHEMBL4472198

CN1CCN(c2nsc(N3CCCCC3)n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 7/20 0.43
HRH1 P35367 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
ATM Q13315 1/20 0.37
TP53 P04637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ESR2 Q92731 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL13817552 0.83 HRH1 (0.42) HRH4HRH1TP53TDP1USP2
SCHEMBL4483298 0.79 USP2 (0.61) HRH4HRH1MEN1KMT2ACYP2C19
SCHEMBL4482650 0.77 HRH1 (0.60) HRH4HRH1KMT2ATDP1USP2
SCHEMBL13817550 0.74 DPP4 (0.43) HRH4KMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL24936706 0.73 HRH4 (0.49) HRH4KMT2A
SCHEMBL13817551 0.73 ALDH1A1 (0.42) HRH4KMT2ATDP1SMN1; SMN2ALDH1A1
SCHEMBL12453031 0.72 DPP4 (0.48) TP53SMN1; SMN2ALDH1A1
SCHEMBL14697858 0.72 CASP1 (0.47) HRH1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL15698276 0.70 HRH4 (0.46) HRH4KMT2ATDP1ALDH1A1
SCHEMBL24256392 0.70 HTR3A (0.41) HRH4

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-7541359-B2 N-heteroarylpiperazinyl ureas as modulators of fatty acid amide hydrolase JANSSEN PHARMACEUTICA N.V. (BE) 2009-06-02 US disclosed
US-20070004741-A1 N-heteroarylpiperazinyl ureas as modulators of fatty acid amide hydrolase APODACA RICHARD 2007-01-04 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-20070004741-A1 N-heteroarylpiperazinyl ureas as modulators of fatty acid amide hydrolase FAAH, FAAH2, CNR2 HRH4 11/4885HRH1 23/4885MEN1 4434/4885

“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.