SCHEMBL2167165

SCHEMBL2167165

CNC1CN(c2cc(N)cc(-c3ccccc3)c2F)C1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 11/20 0.35
HRH3 Q9Y5N1 7/20 0.35
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
GFER P55789 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MCHR1 Q99705 1/20 0.32
TOP1 P11387 1/20 0.32
KCNH2 Q12809 2/20 0.32
HRH1 P35367 1/20 0.31
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL2167236 0.72 HRH4 (0.43) HRH4ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL606055 0.68 HRH4 (0.54) HRH4HRH3KCNH2HRH1
SCHEMBL2166427 0.68 HRH4 (0.43) HRH4HRH3
SCHEMBL21199977 0.66 ALOX5AP (0.42) ALDH1A1LMNAMAPTTDP1
SCHEMBL27907556 0.66 HSD17B10 (0.41) ALDH1A1LMNAMAPTMAPK1GFER
SCHEMBL21965412 0.64 BPTF (0.48) HRH4HRH3ALDH1A1LMNAMAPT
SCHEMBL2801938 0.64 HRH4 (0.52) HRH4HRH3TDP1
SCHEMBL28395841 0.64 HSD17B10 (0.46) ALDH1A1TDP1
SCHEMBL23123592 0.63 HRH3 (0.39) HRH4HRH3KCNH2SLC6A2SLC6A4
SCHEMBL10492501 0.63 HSD17B10 (0.46) ALDH1A1TDP1

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-7985745-B2 Including inflammatory pain, post surgical pain, and neuropathic pain; administering a histamine H4 receptor ligand alone or in combination with a histamine H1, H2, or H3 receptor antagonist or an enzyme inhibitor ABBOTT LABORATORIES (US) 2011-07-26 US disclosed
US-20080194538-A1 Method for Pain Treatment ABBVIE INC. 2008-08-14 US disclosed
WO-2008060766-A2 HISTAMINE H4 RECEPTOR LIGANDS FOR USE IN PAIN TREATMENT ABBOTT LABORATORIES (US) 2008-05-22 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-20080194538-A1 Method for Pain Treatment HRH4, HRH3, HRH2 HRH4 1/4885HRH3 2/4885ALDH1A1 2001/4885

“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.