SCHEMBL4159361

SCHEMBL4159361

CN1CCC(CCCCn2ccc3c(-c4nc5cc(C=O)ccc5[nH]4)cccc32)CC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 8/20 0.37
ACHE P22303 2/20 0.32
SYK P43405 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MCHR1 Q99705 2/20 0.32
CXCR3 P49682 2/20 0.31
FGFR1 P11362 1/20 0.30
FLT1 P17948 1/20 0.30

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
SCHEMBL603878 0.87 HRH4 (0.41) HRH4SYKKDM4ENPC1ALDH1A1
SCHEMBL604317 0.87 HRH4 (0.40) HRH4SYKKDM4ENPC1ALDH1A1
SCHEMBL606639 0.87 HRH4 (0.39) HRH4SYKKDM4ENPC1ALDH1A1
SCHEMBL603691 0.86 HRH4 (0.39) HRH4KDM4ETSHRHSD17B10MCHR1
SCHEMBL605193 0.85 HRH4 (0.38) HRH4ACHESYKKDM4ENPC1
SCHEMBL601656 0.85 HRH4 (0.42) HRH4SYKMCHR1FGFR1FLT1
SCHEMBL604179 0.84 PPARA (0.39) HRH4ACHECXCR3
SCHEMBL603508 0.83 HRH4 (0.36) HRH4ACHESYKFGFR1FLT1
SCHEMBL602343 0.80 HRH4 (0.51) HRH4
SCHEMBL602204 0.79 HRH4 (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156613-A1 Bicyclic heteroaryl-substituted imidazoles as modulators of the histamine H4 receptor KINDRACHUK DAVID E 2009-06-18 US claimed

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-20090156613-A1 Bicyclic heteroaryl-substituted imidazoles as modulators of the histamine H4 receptor HRH4, HRH3, HRH1 HRH4 1/4885ACHE 1465/4885SYK 2484/4885

“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.