SCHEMBL1627975

SCHEMBL1627975

CN1CCC(CCCCOc2cc(C=O)ccn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.43
NMT1 P30419 4/20 0.39
KDM2B Q8NHM5 1/20 0.37
ACHE P22303 2/20 0.36
FFAR4 Q5NUL3 2/20 0.35
ROCK1 Q13464 1/20 0.35
ACACB O00763 1/20 0.34
QPCT Q16769 1/20 0.34
KDM1A O60341 1/20 0.34
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
GPR119 Q8TDV5 3/20 0.33

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
SCHEMBL3426935 0.83 ITGB3 (0.43)
SCHEMBL1628159 0.80 MAOB (0.43) ROCK1
SCHEMBL1625904 0.79 KDM4E (0.41) HRH4NMT1ACHEQPCTKDM1A
SCHEMBL426645 0.79 HRH4 (0.44) HRH4NMT1KDM2BACHEROCK1
SCHEMBL1626586 0.79 HRH4 (0.43) HRH4NMT1CTSLCTSSCTSK
SCHEMBL3422128 0.78 HRH4 (0.51) HRH4NMT1ACHEQPCTCTSL
SCHEMBL3422672 0.78 ALDH1A1 (0.46)
SCHEMBL2193036 0.77 HPGD (0.43)
SCHEMBL3425503 0.77 HRH4 (0.44) HRH4NMT1QPCT
SCHEMBL3422676 0.77 HRH4 (0.44) HRH4NMT1ACHEQPCTCTSL

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1737297-B1 IMIDAZOLE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2012-12-19 EP disclosed
US-8039498-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-10-18 US disclosed
US-8017639-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-09-13 US disclosed
US-8017600-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-09-13 US disclosed
US-7956057-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-06-07 US disclosed
US-7956066-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-06-07 US disclosed
US-7956071-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-06-07 US disclosed
US-7951808-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-05-31 US disclosed
US-7928131-B2 Imidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2011-04-19 US disclosed
US-20100261899-A1 IMIDAZOLE COMPOUNDS BUZARD DANIEL J 2010-10-14 US disclosed
US-20100261898-A1 IMIDAZOLE COMPOUNDS BUZARD DANIEL J 2010-10-14 US disclosed
US-20070265250-A1 Imidazole compounds BUZARD DANIEL J 2007-11-15 US disclosed
US-7253200-B2 Using in leukocyte recruitment inhibition, in modulating H4 receptor expression, and in treating conditions such as inflammation, H4 receptor-mediated conditions JANSSEN PHARMACEUTICA, N.V. (BE) 2007-08-07 US disclosed
US-20070173512-A1 Imidazole compounds JANSSEN PHARMACEUTICA, N.V. 2007-07-26 US disclosed
US-20070173509-A1 Imidazole compounds JANSSEN PHARMACEUTICA, N.V. 2007-07-26 US disclosed
US-20070173510-A1 Imidazole compounds JANSSEN PHARMACEUTICA, N.V. 2007-07-26 US disclosed
US-20070173513-A1 Imidazole compounds JANSSEN PHARMACEUTICA, N.V. 2007-07-26 US disclosed
US-20070149541-A1 Imidazole compounds JANSSEN PHARMACEUTICA, N.V. 2007-06-28 US disclosed
US-20050261309-A1 Imidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2005-11-24 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 (9 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-20070173512-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20100261898-A1 IMIDAZOLE COMPOUNDS HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20070173509-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20070149541-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20070173510-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20070265250-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20100261899-A1 IMIDAZOLE COMPOUNDS HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20070173513-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885
US-20050261309-A1 Imidazole compounds HRH4, HRH3, HRH2 HRH4 1/4885NMT1 1679/4885KDM2B 1334/4885

“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.