SCHEMBL4338440

SCHEMBL4338440

O=C(c1cc2cc(F)ccc2[nH]1)N1CC2CCCNC2C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 3/20 0.54
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
MAPT P10636 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48
MLLT1 Q03111 1/20 0.48
PARP1 P09874 1/20 0.48
KDM4E B2RXH2 1/20 0.46
PDPK1 O15530 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
APEX1 P27695 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
FPR2 P25090 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL4476320 1.00 HRH4 (0.54) HRH4KMT2AMEN1MAPTHRH3
SCHEMBL4338442 1.00 HRH4 (0.54) HRH4KMT2AMEN1MAPTHRH3
Hydrochloric Acid SCHEMBL4480551 0.99 HRH4 (0.53) HRH4KMT2AMEN1MAPTHRH3
Hydrochloric Acid SCHEMBL4480543 0.99 HRH4 (0.53) HRH4KMT2AMEN1MAPTHRH3
Hydrochloric Acid SCHEMBL4480541 0.99 HRH4 (0.53) HRH4KMT2AMEN1MAPTHRH3
SCHEMBL4318604 0.87 HRH4 (0.65) HRH4KMT2AMEN1HRH3PARP1
SCHEMBL4318603 0.87 HRH4 (0.65) HRH4KMT2AMEN1HRH3PARP1
SCHEMBL4319459 0.87 NPC1 (0.59) HRH4KMT2AMEN1HRH3PARP1
SCHEMBL4319461 0.87 NPC1 (0.59) HRH4KMT2AMEN1HRH3PARP1
SCHEMBL4322536 0.87 HRH4 (0.65) HRH4KMT2AMEN1HRH3PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101472584-B Indoles and benzoimidazoles as histamine H4 receptor modulators JANSSEN PHARMACEUTICA NV 2013-04-24 CN claimed
EP-2010172-B1 INDOLES AND BENZOIMIDAZOLES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-08-29 EP claimed
CN-101472584-A Indoles and benzoimidazoles as histamine H4 receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2009-07-01 CN claimed
US-7544698-B2 Indoles and benzoimidazoles as modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, N.V. (BE) 2009-06-09 US claimed
EP-2010172-A2 INDOLES AND BENZOIMIDAZOLES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR Janssen Pharmaceutica, N.V. (BE) 2009-01-07 EP claimed
WO-2007117401-A2 INDOLES AND BENZOIMIDAZOLES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-18 WO claimed
US-20070238771-A1 Indoles and benzoimidazoles as histamine H4 receptor modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-11 US claimed
EP-2010172-B1 INDOLES AND BENZOIMIDAZOLES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-08-29 EP disclosed
US-7544698-B2 Indoles and benzoimidazoles as modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, N.V. (BE) 2009-06-09 US disclosed
US-7544698-B2 Indoles and benzoimidazoles as modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, N.V. (BE) 2009-06-09 US disclosed
WO-2007117401-A2 INDOLES AND BENZOIMIDAZOLES AS MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-18 WO disclosed
US-20070238771-A1 Indoles and benzoimidazoles as histamine H4 receptor modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-11 US disclosed
US-20070238771-A1 Indoles and benzoimidazoles as histamine H4 receptor modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-11 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-20070238771-A1 Indoles and benzoimidazoles as histamine H4 receptor modulators HRH4, HRH3, HRH1 HRH4 1/4885KMT2A 538/4885MEN1 2400/4885

“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.