SCHEMBL1735647

SCHEMBL1735647

Cc1ccc(Br)c(N2CCNCC2)n1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.45
HRH4 Q9H3N8 2/20 0.43
HTR6 P50406 1/20 0.42
ADRB1 P08588 2/20 0.42
ADRB2 P07550 1/20 0.41
NCF1 P14598 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HTR2C P28335 1/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA4 P43681 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL9014675 0.82 ADRB1 (0.49) PRKCIADRB1ADRB2NCF1KDM4E
SCHEMBL20460057 0.81 PIM1 (0.41) HTR2C
SCHEMBL15520545 0.81 HTR3B (0.50) HRH4KDM4EALDH1A1HTT
SCHEMBL31651946 0.77 HTR3E (0.49) HRH4HTR6ADRB1NCF1KDM4E
SCHEMBL1735639 0.76 HRH4 (0.57) HRH4KDM4EALDH1A1HPGD
SCHEMBL6284789 0.73 MAPT (0.52) HTR6ADRB1ALDH1A1HTT
SCHEMBL21815418 0.72 HTR3E (0.50) HTR6ADRB1ADRB2NCF1KDM4E
SCHEMBL24969917 0.72 KDM4E (0.47) HRH4HTR6ADRB1ADRB2KDM4E
SCHEMBL31142888 0.72 KDM4E (0.47) HRH4HTR6ADRB1ADRB2KDM4E
SCHEMBL2366124 0.71 ADRB1 (0.50) HTR6ADRB1ADRB2NCF1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142533-B1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-11-16 EP disclosed
WO-2011069003-A3 METHODS AND SYSTEMS FOR THE TREATMENT OF ANXIETY DISORDERS AND DISORDERS WITH PSYCHOTIC FEATURES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-10-27 WO disclosed
CN-101641348-A Imidazolidinone derivatives HOFFMANN LA ROCHE CH 2010-02-03 CN disclosed
EP-2142533-A1 IMIDAZOLIDINONE DERIVATIVES F. Hoffmann-Roche AG (CH) 2010-01-13 EP disclosed
US-7625902-B2 Imidazolidinone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-12-01 US disclosed
WO-2008119657-A1 IMIDAZOLIDINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-10-09 WO disclosed
US-20080242677-A1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2008-10-02 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-20080242677-A1 IMIDAZOLIDINONE DERIVATIVES NR1H2, NR1H3, NR1I2 PRKCI 471/4885HRH4 379/4885HTR6 3951/4885

“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.